cis-(1S,2S)-N-tert-butyl-2-propan-2-ylcyclopentane-1-carboxamide;cis-(1S,2S)-N,N-dimethyl-2-propan-2-ylcyclopentane-1-carboxamide;cis-(1S,2S)-N,2-di(propan-2-yl)cyclopentane-1-carboxamide;cis-(1S,2S)-N-ethyl-2-propan-2-ylcyclopentane-1-carboxamide;cumene;N-methyl-4-propan-2-ylbenzamide;methyl 2-propan-2-ylbenzoate;methyl 4-propan-2-ylbenzoate;2-propan-2-ylbenzoic acid;3-propan-2-ylbenzoic acid;4-propan-2-ylbenzoic acid;trans-(1R,2S)-N,N-dimethyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-(1R,2S)-N-ethyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-(1R,2S)-N-methyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-methyl (1R,2S)-2-propan-2-ylcyclopentane-1-carboxylate;trans-(1R,2S)-2-propan-2-ylcyclopentane-1-carboxamide;1,1,1-trifluoro-2-methylpropane

C174H284F3N9O21 — CID 160627861

IUPACcis-(1S,2S)-N-tert-butyl-2-propan-2-ylcyclopentane-1-carboxamide;cis-(1S,2S)-N,N-dimethyl-2-propan-2-ylcyclopentane-1-carboxamide;cis-(1S,2S)-N,2-di(propan-2-yl)cyclopentane-1-carboxamide;cis-(1S,2S)-N-ethyl-2-propan-2-ylcyclopentane-1-carboxamide;cumene;N-methyl-4-propan-2-ylbenzamide;methyl 2-propan-2-ylbenzoate;methyl 4-propan-2-ylbenzoate;2-propan-2-ylbenzoic acid;3-propan-2-ylbenzoic acid;4-propan-2-ylbenzoic acid;trans-(1R,2S)-N,N-dimethyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-(1R,2S)-N-ethyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-(1R,2S)-N-methyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-methyl (1R,2S)-2-propan-2-ylcyclopentane-1-carboxylate;trans-(1R,2S)-2-propan-2-ylcyclopentane-1-carboxamide;1,1,1-trifluoro-2-methylpropane
SMILESCC(C)C(F)(F)F.CC(C)NC(=O)[C@H]1CCC[C@H]1C(C)C.CC(C)[C@@H]1CCC[C@@H]1C(=O)N(C)C.CC(C)[C@@H]1CCC[C@@H]1C(=O)NC(C)(C)C.CC(C)[C@@H]1CCC[C@H]1C(=O)N(C)C.CC(C)[C@@H]1CCC[C@H]1C(N)=O.CC(C)c1ccc(C(=O)O)cc1.CC(C)c1cccc(C(=O)O)c1.CC(C)c1ccccc1.CC(C)c1ccccc1C(=O)O.CCNC(=O)[C@@H]1CCC[C@H]1C(C)C.CCNC(=O)[C@H]1CCC[C@H]1C(C)C.CNC(=O)[C@@H]1CCC[C@H]1C(C)C.CNC(=O)c1ccc(C(C)C)cc1.COC(=O)[C@@H]1CCC[C@H]1C(C)C.COC(=O)c1ccc(C(C)C)cc1.COC(=O)c1ccccc1C(C)C
InChIInChI=1S/C13H25NO.C12H23NO.2C11H21NO.C11H15NO.2C11H21NO.2C11H14O2.C10H19NO.C10H18O2.3C10H12O2.C9H17NO.C9H12.C4H7F3/c1-9(2)10-7-6-8-11(10)12(15)14-13(3,4)5;1-8(2)10-6-5-7-11(10)12(14)13-9(3)4;2*1-8(2)9-6-5-7-10(9)11(13)12(3)4;1-8(2)9-4-6-10(7-5-9)11(13)12-3;2*1-4-12-11(13)10-7-5-6-9(10)8(2)3;1-8(2)9-4-6-10(7-5-9)11(12)13-3;1-8(2)9-6-4-5-7-10(9)11(12)13-3;1-7(2)8-5-4-6-9(8)10(12)11-3;1-7(2)8-5-4-6-9(8)10(11)12-3;1-7(2)8-3-5-9(6-4-8)10(11)12;1-7(2)8-4-3-5-9(6-8)10(11)12;1-7(2)8-5-3-4-6-9(8)10(11)12;1-6(2)7-4-3-5-8(7)9(10)11;1-8(2)9-6-4-3-5-7-9;1-3(2)4(5,6)7/h9-11H,6-8H2,1-5H3,(H,14,15);8-11H,5-7H2,1-4H3,(H,13,14);2*8-10H,5-7H2,1-4H3;4-8H,1-3H3,(H,12,13);2*8-10H,4-7H2,1-3H3,(H,12,13);2*4-8H,1-3H3;7-9H,4-6H2,1-3H3,(H,11,12);7-9H,4-6H2,1-3H3;3*3-7H,1-2H3,(H,11,12);6-8H,3-5H2,1-2H3,(H2,10,11);3-8H,1-2H3;3H,1-2H3/t2*10-,11-;9-,10+;9-,10-;;9-,10+;9-,10-;;;2*8-,9+;;;;7-,8+;;/m0000.00..00...0../s1
InChIKeyRHNQJCGHFKZHNE-JNGDYZOESA-N
MW2895.22 g/mol
LogP39.72
Rot. Bonds34

About cis-(1S,2S)-N-tert-butyl-2-propan-2-ylcyclopentane-1-carboxamide;cis-(1S,2S)-N,N-dimethyl-2-propan-2-ylcyclopentane-1-carboxamide;cis-(1S,2S)-N,2-di(propan-2-yl)cyclopentane-1-carboxamide;cis-(1S,2S)-N-ethyl-2-propan-2-ylcyclopentane-1-carboxamide;cumene;N-methyl-4-propan-2-ylbenzamide;methyl 2-propan-2-ylbenzoate;methyl 4-propan-2-ylbenzoate;2-propan-2-ylbenzoic acid;3-propan-2-ylbenzoic acid;4-propan-2-ylbenzoic acid;trans-(1R,2S)-N,N-dimethyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-(1R,2S)-N-ethyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-(1R,2S)-N-methyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-methyl (1R,2S)-2-propan-2-ylcyclopentane-1-carboxylate;trans-(1R,2S)-2-propan-2-ylcyclopentane-1-carboxamide;1,1,1-trifluoro-2-methylpropane

cis-(1S,2S)-N-tert-butyl-2-propan-2-ylcyclopentane-1-carboxamide;cis-(1S,2S)-N,N-dimethyl-2-propan-2-ylcyclopentane-1-carboxamide;cis-(1S,2S)-N,2-di(propan-2-yl)cyclopentane-1-carboxamide;cis-(1S,2S)-N-ethyl-2-propan-2-ylcyclopentane-1-carboxamide;cumene;N-methyl-4-propan-2-ylbenzamide;methyl 2-propan-2-ylbenzoate;methyl 4-propan-2-ylbenzoate;2-propan-2-ylbenzoic acid;3-propan-2-ylbenzoic acid;4-propan-2-ylbenzoic acid;trans-(1R,2S)-N,N-dimethyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-(1R,2S)-N-ethyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-(1R,2S)-N-methyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-methyl (1R,2S)-2-propan-2-ylcyclopentane-1-carboxylate;trans-(1R,2S)-2-propan-2-ylcyclopentane-1-carboxamide;1,1,1-trifluoro-2-methylpropane (PubChem CID 160627861) has the molecular formula C174H284F3N9O21 and a molecular weight of 2895.22 g/mol. Its IUPAC name is cis-(1S,2S)-N-tert-butyl-2-propan-2-ylcyclopentane-1-carboxamide;cis-(1S,2S)-N,N-dimethyl-2-propan-2-ylcyclopentane-1-carboxamide;cis-(1S,2S)-N,2-di(propan-2-yl)cyclopentane-1-carboxamide;cis-(1S,2S)-N-ethyl-2-propan-2-ylcyclopentane-1-carboxamide;cumene;N-methyl-4-propan-2-ylbenzamide;methyl 2-propan-2-ylbenzoate;methyl 4-propan-2-ylbenzoate;2-propan-2-ylbenzoic acid;3-propan-2-ylbenzoic acid;4-propan-2-ylbenzoic acid;trans-(1R,2S)-N,N-dimethyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-(1R,2S)-N-ethyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-(1R,2S)-N-methyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-methyl (1R,2S)-2-propan-2-ylcyclopentane-1-carboxylate;trans-(1R,2S)-2-propan-2-ylcyclopentane-1-carboxamide;1,1,1-trifluoro-2-methylpropane.

Molecular Properties

Compound Namecis-(1S,2S)-N-tert-butyl-2-propan-2-ylcyclopentane-1-carboxamide;cis-(1S,2S)-N,N-dimethyl-2-propan-2-ylcyclopentane-1-carboxamide;cis-(1S,2S)-N,2-di(propan-2-yl)cyclopentane-1-carboxamide;cis-(1S,2S)-N-ethyl-2-propan-2-ylcyclopentane-1-carboxamide;cumene;N-methyl-4-propan-2-ylbenzamide;methyl 2-propan-2-ylbenzoate;methyl 4-propan-2-ylbenzoate;2-propan-2-ylbenzoic acid;3-propan-2-ylbenzoic acid;4-propan-2-ylbenzoic acid;trans-(1R,2S)-N,N-dimethyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-(1R,2S)-N-ethyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-(1R,2S)-N-methyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-methyl (1R,2S)-2-propan-2-ylcyclopentane-1-carboxylate;trans-(1R,2S)-2-propan-2-ylcyclopentane-1-carboxamide;1,1,1-trifluoro-2-methylpropane
PubChem CID160627861
Molecular FormulaC174H284F3N9O21
Molecular Weight2895.22 g/mol
Exact Mass2893.14
IUPAC Namecis-(1S,2S)-N-tert-butyl-2-propan-2-ylcyclopentane-1-carboxamide;cis-(1S,2S)-N,N-dimethyl-2-propan-2-ylcyclopentane-1-carboxamide;cis-(1S,2S)-N,2-di(propan-2-yl)cyclopentane-1-carboxamide;cis-(1S,2S)-N-ethyl-2-propan-2-ylcyclopentane-1-carboxamide;cumene;N-methyl-4-propan-2-ylbenzamide;methyl 2-propan-2-ylbenzoate;methyl 4-propan-2-ylbenzoate;2-propan-2-ylbenzoic acid;3-propan-2-ylbenzoic acid;4-propan-2-ylbenzoic acid;trans-(1R,2S)-N,N-dimethyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-(1R,2S)-N-ethyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-(1R,2S)-N-methyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-methyl (1R,2S)-2-propan-2-ylcyclopentane-1-carboxylate;trans-(1R,2S)-2-propan-2-ylcyclopentane-1-carboxamide;1,1,1-trifluoro-2-methylpropane
SMILESCC(C)C(F)(F)F.CC(C)NC(=O)[C@H]1CCC[C@H]1C(C)C.CC(C)[C@@H]1CCC[C@@H]1C(=O)N(C)C.CC(C)[C@@H]1CCC[C@@H]1C(=O)NC(C)(C)C.CC(C)[C@@H]1CCC[C@H]1C(=O)N(C)C.CC(C)[C@@H]1CCC[C@H]1C(N)=O.CC(C)c1ccc(C(=O)O)cc1.CC(C)c1cccc(C(=O)O)c1.CC(C)c1ccccc1.CC(C)c1ccccc1C(=O)O.CCNC(=O)[C@@H]1CCC[C@H]1C(C)C.CCNC(=O)[C@H]1CCC[C@H]1C(C)C.CNC(=O)[C@@H]1CCC[C@H]1C(C)C.CNC(=O)c1ccc(C(C)C)cc1.COC(=O)[C@@H]1CCC[C@H]1C(C)C.COC(=O)c1ccc(C(C)C)cc1.COC(=O)c1ccccc1C(C)C
InChIInChI=1S/C13H25NO.C12H23NO.2C11H21NO.C11H15NO.2C11H21NO.2C11H14O2.C10H19NO.C10H18O2.3C10H12O2.C9H17NO.C9H12.C4H7F3/c1-9(2)10-7-6-8-11(10)12(15)14-13(3,4)5;1-8(2)10-6-5-7-11(10)12(14)13-9(3)4;2*1-8(2)9-6-5-7-10(9)11(13)12(3)4;1-8(2)9-4-6-10(7-5-9)11(13)12-3;2*1-4-12-11(13)10-7-5-6-9(10)8(2)3;1-8(2)9-4-6-10(7-5-9)11(12)13-3;1-8(2)9-6-4-5-7-10(9)11(12)13-3;1-7(2)8-5-4-6-9(8)10(12)11-3;1-7(2)8-5-4-6-9(8)10(11)12-3;1-7(2)8-3-5-9(6-4-8)10(11)12;1-7(2)8-4-3-5-9(6-8)10(11)12;1-7(2)8-5-3-4-6-9(8)10(11)12;1-6(2)7-4-3-5-8(7)9(10)11;1-8(2)9-6-4-3-5-7-9;1-3(2)4(5,6)7/h9-11H,6-8H2,1-5H3,(H,14,15);8-11H,5-7H2,1-4H3,(H,13,14);2*8-10H,5-7H2,1-4H3;4-8H,1-3H3,(H,12,13);2*8-10H,4-7H2,1-3H3,(H,12,13);2*4-8H,1-3H3;7-9H,4-6H2,1-3H3,(H,11,12);7-9H,4-6H2,1-3H3;3*3-7H,1-2H3,(H,11,12);6-8H,3-5H2,1-2H3,(H2,10,11);3-8H,1-2H3;3H,1-2H3/t2*10-,11-;9-,10+;9-,10-;;9-,10+;9-,10-;;;2*8-,9+;;;;7-,8+;;/m0000.00..00...0../s1
InChIKeyRHNQJCGHFKZHNE-JNGDYZOESA-N
XLogP39.72
TPSA449.11 Ų
H-Bond Donors10
H-Bond Acceptors18
Rotatable Bonds34
Heavy Atoms207
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002895.22
LogP ≤ 539.72
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1018

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}

Analyze cis-(1S,2S)-N-tert-butyl-2-propan-2-ylcyclopentane-1-carboxamide;cis-(1S,2S)-N,N-dimethyl-2-propan-2-ylcyclopentane-1-carboxamide;cis-(1S,2S)-N,2-di(propan-2-yl)cyclopentane-1-carboxamide;cis-(1S,2S)-N-ethyl-2-propan-2-ylcyclopentane-1-carboxamide;cumene;N-methyl-4-propan-2-ylbenzamide;methyl 2-propan-2-ylbenzoate;methyl 4-propan-2-ylbenzoate;2-propan-2-ylbenzoic acid;3-propan-2-ylbenzoic acid;4-propan-2-ylbenzoic acid;trans-(1R,2S)-N,N-dimethyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-(1R,2S)-N-ethyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-(1R,2S)-N-methyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-methyl (1R,2S)-2-propan-2-ylcyclopentane-1-carboxylate;trans-(1R,2S)-2-propan-2-ylcyclopentane-1-carboxamide;1,1,1-trifluoro-2-methylpropane with MolForge

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Related Compounds

(2-Benzamido-3-benzoyloxypropyl) benzoate;[2-[(4-butylbenzoyl)amino]-3-(4-butylbenzoyl)oxypropyl] 4-butylbenzoate;2-[(2-methylbenzoyl)-[2-(2-methylbenzoyl)oxyethyl]amino]ethyl 2-methylbenzoate;2-[[4-(trifluoromethyl)benzoyl]-[2-[4-(trifluoromethyl)benzoyl]oxyethyl]amino]ethyl 4-methylbenzoate;2-[(2,4,6-trimethylbenzoyl)-[2-(2,4,6-trimethylbenzoyl)oxyethyl]amino]ethyl 2,4,6-trimethylbenzoate
CID 157611002
lithium;1-(7-acetyl-1,2,4,5-tetrahydro-3-benzazepin-3-yl)-2,2,2-trifluoroethanone;tert-butyl 7-acetyl-1,2,4,5-tetrahydro-3-benzazepine-3-carboxylate;methyl 3-methyl-1,2,4,5-tetrahydro-3-benzazepine-7-carboxylate;3-[(2-methylpropan-2-yl)oxycarbonyl]-1,2,4,5-tetrahydro-3-benzazepine-7-carboxylic acid;methyl 2,3,4,5-tetrahydro-1H-3-benzazepine-7-carboxylate;(3-methyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)methanone;2,2,2-trifluoro-1-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)ethanone;N,N,3-trimethyl-1,2,4,5-tetrahydro-3-benzazepine-7-carboxamide;hydroxide
CID 157969540
methyl (3R)-3-amino-2,3-dihydro-1H-indene-5-carboxylate;methyl (3R)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2,3-dihydro-1H-indene-5-carboxylate;methyl (3R)-3-[(2,2,2-trifluoroacetyl)amino]-2,3-dihydro-1H-indene-5-carboxylate;methyl (3R)-3-(2,2,2-trifluoroethylamino)-2,3-dihydro-1H-indene-5-carboxylate
CID 158205642
bis(N-[[(1S,3R)-3-(aminomethyl)cyclopentyl]methyl]-3,5-bis[4-(trifluoromethyl)phenyl]benzamide);[(2S,4S)-1-benzyl-4-ethylpyrrolidin-2-yl]methanamine;N-[[(2S,4S)-1-benzyl-4-ethylpyrrolidin-2-yl]methyl]-3,5-bis[4-(trifluoromethyl)phenyl]benzamide;3,5-bis[4-(trifluoromethyl)phenyl]benzoic acid;methanol;hydrochloride
CID 159121193
2-[3-[3-Acetyl-4-(1-hydroxyethenyl)phenyl]propanoyl]benzoic acid;2-[(4-acetyl-2-methylphenyl)methylcarbamoyl]benzoic acid;2-[1-(4-acetylphenyl)ethylcarbamoyl]benzoic acid;2-[2-(4-acetylphenyl)propan-2-ylcarbamoyl]benzoic acid;2-[[1-(4-acetylphenyl)-2,2,2-trifluoroethyl]carbamoyl]benzoic acid
CID 159531334
CID 160942259
CID 160942259
cis-(1S,2S)-N-tert-butyl-2-propan-2-ylcyclopentane-1-carboxamide;cis-(1S,2S)-N,N-dimethyl-2-propan-2-ylcyclopentane-1-carboxamide;cis-(1S,2S)-N,2-di(propan-2-yl)cyclopentane-1-carboxamide;cis-(1S,2S)-N-ethyl-2-propan-2-ylcyclopentane-1-carboxamide;cumene;2,5-dimethyl-3-propan-2-ylthiophene;N-methyl-2-propan-2-ylbenzamide;N-methyl-3-propan-2-ylbenzamide;N-methyl-4-propan-2-ylbenzamide;methyl 2-propan-2-ylbenzoate;methyl 3-propan-2-ylbenzoate;methyl 4-propan-2-ylbenzoate;4-propan-2-ylbenzamide;2-propan-2-ylbenzoic acid;3-propan-2-ylbenzoic acid;4-propan-2-ylbenzoic acid;2-propan-2-ylthiophene;3-propan-2-ylthiophene;trans-(1R,2S)-N,N-dimethyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-(1R,2S)-N-ethyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-(1R,2S)-N-methyl-2-propan-2-ylcyclopentane-1-carboxamide;1,1,1-trifluoro-2-methylpropane
CID 161909029
methyl (Z)-7-[(1S,2R,3R,4R)-3-amino-2-bicyclo[2.2.1]heptanyl]hept-5-enoate;methyl (Z)-7-[(1S,2R,3R,4R)-3-[(4-phenylbenzoyl)amino]-2-bicyclo[2.2.1]heptanyl]hept-5-enoate;(Z)-7-[(1S,2R,3R,4R)-3-[(4-phenylbenzoyl)amino]-2-bicyclo[2.2.1]heptanyl]hept-5-enoic acid;2,2,2-trifluoroacetic acid
CID 162237814
(E)-4-[1-[2-[3,5-bis(trifluoromethyl)phenyl]ethylamino]-2,3-dihydro-1H-inden-5-yl]-1-hydroxybut-3-en-2-one;(E)-3-[1-[2-[3,5-bis(trifluoromethyl)phenyl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-2,3-dihydro-1H-inden-5-yl]prop-2-enoic acid;tert-butyl N-[2-[3,5-bis(trifluoromethyl)phenyl]ethyl]-N-[5-[(E)-3-oxopent-1-enyl]-2,3-dihydro-1H-inden-1-yl]carbamate;methyl (E)-3-[1-[2-[3,5-bis(trifluoromethyl)phenyl]ethylamino]-2,3-dihydro-1H-inden-5-yl]prop-2-enoate;methyl (E)-3-[1-[2-[3,5-bis(trifluoromethyl)phenyl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-2,3-dihydro-1H-inden-5-yl]prop-2-enoate;methyl (E)-3-(1-oxo-2,3-dihydroinden-5-yl)prop-2-enoate
CID 165039935
N-hydroxy-2'-oxo-1'-[[4-(trifluoromethyl)phenyl]methyl]spiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxamide;methyl 2'-oxo-1'-[[4-(trifluoromethyl)phenyl]methyl]spiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate;methyl spiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate;2'-oxo-1'-[[4-(trifluoromethyl)phenyl]methyl]spiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylic acid
CID 167593186
N-hydroxy-1'-(4-methylbenzoyl)spiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxamide;1'-(4-methylbenzoyl)spiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylic acid;methyl 1'-(4-methylbenzoyl)spiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate;methyl spiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate
CID 157529517
tert-butyl (1S)-1-amino-4-methyl-2,3-dihydro-1H-indene-5-carboxylate;tert-butyl (1S)-4-methyl-1-[(2-methylpropan-2-yl)oxycarbonylamino]-2,3-dihydro-1H-indene-5-carboxylate;methyl (1S)-1-amino-2,3-dihydro-1H-indene-5-carboxylate;methyl (1S)-4-methyl-1-[(2-methylpropan-2-yl)oxycarbonylamino]-2,3-dihydro-1H-indene-5-carboxylate;(1S)-4-methyl-1-[(2-methylpropan-2-yl)oxycarbonylamino]-2,3-dihydro-1H-indene-5-carboxylic acid;hydrochloride
CID 158222863

Frequently Asked Questions

What is the IUPAC name of cis-(1S,2S)-N-tert-butyl-2-propan-2-ylcyclopentane-1-carboxamide;cis-(1S,2S)-N,N-dimethyl-2-propan-2-ylcyclopentane-1-carboxamide;cis-(1S,2S)-N,2-di(propan-2-yl)cyclopentane-1-carboxamide;cis-(1S,2S)-N-ethyl-2-propan-2-ylcyclopentane-1-carboxamide;cumene;N-methyl-4-propan-2-ylbenzamide;methyl 2-propan-2-ylbenzoate;methyl 4-propan-2-ylbenzoate;2-propan-2-ylbenzoic acid;3-propan-2-ylbenzoic acid;4-propan-2-ylbenzoic acid;trans-(1R,2S)-N,N-dimethyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-(1R,2S)-N-ethyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-(1R,2S)-N-methyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-methyl (1R,2S)-2-propan-2-ylcyclopentane-1-carboxylate;trans-(1R,2S)-2-propan-2-ylcyclopentane-1-carboxamide;1,1,1-trifluoro-2-methylpropane?
The IUPAC name of cis-(1S,2S)-N-tert-butyl-2-propan-2-ylcyclopentane-1-carboxamide;cis-(1S,2S)-N,N-dimethyl-2-propan-2-ylcyclopentane-1-carboxamide;cis-(1S,2S)-N,2-di(propan-2-yl)cyclopentane-1-carboxamide;cis-(1S,2S)-N-ethyl-2-propan-2-ylcyclopentane-1-carboxamide;cumene;N-methyl-4-propan-2-ylbenzamide;methyl 2-propan-2-ylbenzoate;methyl 4-propan-2-ylbenzoate;2-propan-2-ylbenzoic acid;3-propan-2-ylbenzoic acid;4-propan-2-ylbenzoic acid;trans-(1R,2S)-N,N-dimethyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-(1R,2S)-N-ethyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-(1R,2S)-N-methyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-methyl (1R,2S)-2-propan-2-ylcyclopentane-1-carboxylate;trans-(1R,2S)-2-propan-2-ylcyclopentane-1-carboxamide;1,1,1-trifluoro-2-methylpropane (CID 160627861) is cis-(1S,2S)-N-tert-butyl-2-propan-2-ylcyclopentane-1-carboxamide;cis-(1S,2S)-N,N-dimethyl-2-propan-2-ylcyclopentane-1-carboxamide;cis-(1S,2S)-N,2-di(propan-2-yl)cyclopentane-1-carboxamide;cis-(1S,2S)-N-ethyl-2-propan-2-ylcyclopentane-1-carboxamide;cumene;N-methyl-4-propan-2-ylbenzamide;methyl 2-propan-2-ylbenzoate;methyl 4-propan-2-ylbenzoate;2-propan-2-ylbenzoic acid;3-propan-2-ylbenzoic acid;4-propan-2-ylbenzoic acid;trans-(1R,2S)-N,N-dimethyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-(1R,2S)-N-ethyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-(1R,2S)-N-methyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-methyl (1R,2S)-2-propan-2-ylcyclopentane-1-carboxylate;trans-(1R,2S)-2-propan-2-ylcyclopentane-1-carboxamide;1,1,1-trifluoro-2-methylpropane.
What is the SMILES notation for cis-(1S,2S)-N-tert-butyl-2-propan-2-ylcyclopentane-1-carboxamide;cis-(1S,2S)-N,N-dimethyl-2-propan-2-ylcyclopentane-1-carboxamide;cis-(1S,2S)-N,2-di(propan-2-yl)cyclopentane-1-carboxamide;cis-(1S,2S)-N-ethyl-2-propan-2-ylcyclopentane-1-carboxamide;cumene;N-methyl-4-propan-2-ylbenzamide;methyl 2-propan-2-ylbenzoate;methyl 4-propan-2-ylbenzoate;2-propan-2-ylbenzoic acid;3-propan-2-ylbenzoic acid;4-propan-2-ylbenzoic acid;trans-(1R,2S)-N,N-dimethyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-(1R,2S)-N-ethyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-(1R,2S)-N-methyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-methyl (1R,2S)-2-propan-2-ylcyclopentane-1-carboxylate;trans-(1R,2S)-2-propan-2-ylcyclopentane-1-carboxamide;1,1,1-trifluoro-2-methylpropane?
The canonical SMILES for cis-(1S,2S)-N-tert-butyl-2-propan-2-ylcyclopentane-1-carboxamide;cis-(1S,2S)-N,N-dimethyl-2-propan-2-ylcyclopentane-1-carboxamide;cis-(1S,2S)-N,2-di(propan-2-yl)cyclopentane-1-carboxamide;cis-(1S,2S)-N-ethyl-2-propan-2-ylcyclopentane-1-carboxamide;cumene;N-methyl-4-propan-2-ylbenzamide;methyl 2-propan-2-ylbenzoate;methyl 4-propan-2-ylbenzoate;2-propan-2-ylbenzoic acid;3-propan-2-ylbenzoic acid;4-propan-2-ylbenzoic acid;trans-(1R,2S)-N,N-dimethyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-(1R,2S)-N-ethyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-(1R,2S)-N-methyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-methyl (1R,2S)-2-propan-2-ylcyclopentane-1-carboxylate;trans-(1R,2S)-2-propan-2-ylcyclopentane-1-carboxamide;1,1,1-trifluoro-2-methylpropane is CC(C)C(F)(F)F.CC(C)NC(=O)[C@H]1CCC[C@H]1C(C)C.CC(C)[C@@H]1CCC[C@@H]1C(=O)N(C)C.CC(C)[C@@H]1CCC[C@@H]1C(=O)NC(C)(C)C.CC(C)[C@@H]1CCC[C@H]1C(=O)N(C)C.CC(C)[C@@H]1CCC[C@H]1C(N)=O.CC(C)c1ccc(C(=O)O)cc1.CC(C)c1cccc(C(=O)O)c1.CC(C)c1ccccc1.CC(C)c1ccccc1C(=O)O.CCNC(=O)[C@@H]1CCC[C@H]1C(C)C.CCNC(=O)[C@H]1CCC[C@H]1C(C)C.CNC(=O)[C@@H]1CCC[C@H]1C(C)C.CNC(=O)c1ccc(C(C)C)cc1.COC(=O)[C@@H]1CCC[C@H]1C(C)C.COC(=O)c1ccc(C(C)C)cc1.COC(=O)c1ccccc1C(C)C.
What is the InChIKey of cis-(1S,2S)-N-tert-butyl-2-propan-2-ylcyclopentane-1-carboxamide;cis-(1S,2S)-N,N-dimethyl-2-propan-2-ylcyclopentane-1-carboxamide;cis-(1S,2S)-N,2-di(propan-2-yl)cyclopentane-1-carboxamide;cis-(1S,2S)-N-ethyl-2-propan-2-ylcyclopentane-1-carboxamide;cumene;N-methyl-4-propan-2-ylbenzamide;methyl 2-propan-2-ylbenzoate;methyl 4-propan-2-ylbenzoate;2-propan-2-ylbenzoic acid;3-propan-2-ylbenzoic acid;4-propan-2-ylbenzoic acid;trans-(1R,2S)-N,N-dimethyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-(1R,2S)-N-ethyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-(1R,2S)-N-methyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-methyl (1R,2S)-2-propan-2-ylcyclopentane-1-carboxylate;trans-(1R,2S)-2-propan-2-ylcyclopentane-1-carboxamide;1,1,1-trifluoro-2-methylpropane?
The InChIKey is RHNQJCGHFKZHNE-JNGDYZOESA-N. The full InChI is InChI=1S/C13H25NO.C12H23NO.2C11H21NO.C11H15NO.2C11H21NO.2C11H14O2.C10H19NO.C10H18O2.3C10H12O2.C9H17NO.C9H12.C4H7F3/c1-9(2)10-7-6-8-11(10)12(15)14-13(3,4)5;1-8(2)10-6-5-7-11(10)12(14)13-9(3)4;2*1-8(2)9-6-5-7-10(9)11(13)12(3)4;1-8(2)9-4-6-10(7-5-9)11(13)12-3;2*1-4-12-11(13)10-7-5-6-9(10)8(2)3;1-8(2)9-4-6-10(7-5-9)11(12)13-3;1-8(2)9-6-4-5-7-10(9)11(12)13-3;1-7(2)8-5-4-6-9(8)10(12)11-3;1-7(2)8-5-4-6-9(8)10(11)12-3;1-7(2)8-3-5-9(6-4-8)10(11)12;1-7(2)8-4-3-5-9(6-8)10(11)12;1-7(2)8-5-3-4-6-9(8)10(11)12;1-6(2)7-4-3-5-8(7)9(10)11;1-8(2)9-6-4-3-5-7-9;1-3(2)4(5,6)7/h9-11H,6-8H2,1-5H3,(H,14,15);8-11H,5-7H2,1-4H3,(H,13,14);2*8-10H,5-7H2,1-4H3;4-8H,1-3H3,(H,12,13);2*8-10H,4-7H2,1-3H3,(H,12,13);2*4-8H,1-3H3;7-9H,4-6H2,1-3H3,(H,11,12);7-9H,4-6H2,1-3H3;3*3-7H,1-2H3,(H,11,12);6-8H,3-5H2,1-2H3,(H2,10,11);3-8H,1-2H3;3H,1-2H3/t2*10-,11-;9-,10+;9-,10-;;9-,10+;9-,10-;;;2*8-,9+;;;;7-,8+;;/m0000.00..00...0../s1.
What are the key properties of cis-(1S,2S)-N-tert-butyl-2-propan-2-ylcyclopentane-1-carboxamide;cis-(1S,2S)-N,N-dimethyl-2-propan-2-ylcyclopentane-1-carboxamide;cis-(1S,2S)-N,2-di(propan-2-yl)cyclopentane-1-carboxamide;cis-(1S,2S)-N-ethyl-2-propan-2-ylcyclopentane-1-carboxamide;cumene;N-methyl-4-propan-2-ylbenzamide;methyl 2-propan-2-ylbenzoate;methyl 4-propan-2-ylbenzoate;2-propan-2-ylbenzoic acid;3-propan-2-ylbenzoic acid;4-propan-2-ylbenzoic acid;trans-(1R,2S)-N,N-dimethyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-(1R,2S)-N-ethyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-(1R,2S)-N-methyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-methyl (1R,2S)-2-propan-2-ylcyclopentane-1-carboxylate;trans-(1R,2S)-2-propan-2-ylcyclopentane-1-carboxamide;1,1,1-trifluoro-2-methylpropane?
cis-(1S,2S)-N-tert-butyl-2-propan-2-ylcyclopentane-1-carboxamide;cis-(1S,2S)-N,N-dimethyl-2-propan-2-ylcyclopentane-1-carboxamide;cis-(1S,2S)-N,2-di(propan-2-yl)cyclopentane-1-carboxamide;cis-(1S,2S)-N-ethyl-2-propan-2-ylcyclopentane-1-carboxamide;cumene;N-methyl-4-propan-2-ylbenzamide;methyl 2-propan-2-ylbenzoate;methyl 4-propan-2-ylbenzoate;2-propan-2-ylbenzoic acid;3-propan-2-ylbenzoic acid;4-propan-2-ylbenzoic acid;trans-(1R,2S)-N,N-dimethyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-(1R,2S)-N-ethyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-(1R,2S)-N-methyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-methyl (1R,2S)-2-propan-2-ylcyclopentane-1-carboxylate;trans-(1R,2S)-2-propan-2-ylcyclopentane-1-carboxamide;1,1,1-trifluoro-2-methylpropane has a molecular weight of 2895.22 g/mol, XLogP of 39.72, 34 rotatable bonds, 10 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1S,2S)-N-tert-butyl-2-propan-2-ylcyclopentane-1-carboxamide;cis-(1S,2S)-N,N-dimethyl-2-propan-2-ylcyclopentane-1-carboxamide;cis-(1S,2S)-N,2-di(propan-2-yl)cyclopentane-1-carboxamide;cis-(1S,2S)-N-ethyl-2-propan-2-ylcyclopentane-1-carboxamide;cumene;N-methyl-4-propan-2-ylbenzamide;methyl 2-propan-2-ylbenzoate;methyl 4-propan-2-ylbenzoate;2-propan-2-ylbenzoic acid;3-propan-2-ylbenzoic acid;4-propan-2-ylbenzoic acid;trans-(1R,2S)-N,N-dimethyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-(1R,2S)-N-ethyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-(1R,2S)-N-methyl-2-propan-2-ylcyclopentane-1-carboxamide;trans-methyl (1R,2S)-2-propan-2-ylcyclopentane-1-carboxylate;trans-(1R,2S)-2-propan-2-ylcyclopentane-1-carboxamide;1,1,1-trifluoro-2-methylpropane is sourced from PubChem (CID 160627861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).