N-tert-butylcyclopentanamine;N-tert-butyl-N',N'-diethylethane-1,2-diamine;1-tert-butyl-N,N-dimethylpiperidin-4-amine;N-tert-butyl-3-methylpiperidin-4-amine;N-tert-butylpiperidin-3-amine;N-tert-butylpiperidin-4-amine;3,3-difluoropiperidin-4-amine;1-ethyl-3-fluoropiperidin-4-amine;1-ethylpiperidin-3-amine;1-ethylpyrrolidin-3-amine;N-[(4-fluoropiperidin-4-yl)methyl]-2-methylpropan-2-amine;methane;2-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]propan-2-amine;4-methylpiperidin-4-amine;hexakis(2-methylpropane);3-[(2-methylpropan-2-yl)oxy]-1-azabicyclo[2.2.1]heptane;oxan-2-ylmethanamine

C150H337F4N27O2 — CID 158614735

IUPACN-tert-butylcyclopentanamine;N-tert-butyl-N',N'-diethylethane-1,2-diamine;1-tert-butyl-N,N-dimethylpiperidin-4-amine;N-tert-butyl-3-methylpiperidin-4-amine;N-tert-butylpiperidin-3-amine;N-tert-butylpiperidin-4-amine;3,3-difluoropiperidin-4-amine;1-ethyl-3-fluoropiperidin-4-amine;1-ethylpiperidin-3-amine;1-ethylpyrrolidin-3-amine;N-[(4-fluoropiperidin-4-yl)methyl]-2-methylpropan-2-amine;methane;2-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]propan-2-amine;4-methylpiperidin-4-amine;hexakis(2-methylpropane);3-[(2-methylpropan-2-yl)oxy]-1-azabicyclo[2.2.1]heptane;oxan-2-ylmethanamine
SMILESC.CC(C)(C)NC1CCCC1.CC(C)(C)NC1CCCNC1.CC(C)(C)NC1CCNCC1.CC(C)(C)NCC1(F)CCNCC1.CC(C)(C)OC1CN2CCC1C2.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC1(N)CCNCC1.CC1CNCCC1NC(C)(C)C.CCN(CC)CCNC(C)(C)C.CCN1CCC(N)C(F)C1.CCN1CCC(N)C1.CCN1CCCC(N)C1.CN(C)C1CCN(C(C)(C)C)CC1.CN1CCC(CNC(C)(C)C)C1.NC1CCNCC1(F)F.NCC1CCCCO1
InChIInChI=1S/C11H24N2.C10H21FN2.2C10H22N2.C10H24N2.C10H19NO.2C9H20N2.C9H19N.C7H15FN2.C7H16N2.2C6H14N2.C6H13NO.C5H10F2N2.6C4H10.CH4/c1-11(2,3)13-8-6-10(7-9-13)12(4)5;1-9(2,3)13-8-10(11)4-6-12-7-5-10;1-10(2,3)11-7-9-5-6-12(4)8-9;1-8-7-11-6-5-9(8)12-10(2,3)4;1-6-12(7-2)9-8-11-10(3,4)5;1-10(2,3)12-9-7-11-5-4-8(9)6-11;1-9(2,3)11-8-4-6-10-7-5-8;1-9(2,3)11-8-5-4-6-10-7-8;1-9(2,3)10-8-6-4-5-7-8;1-2-10-4-3-7(9)6(8)5-10;1-2-9-5-3-4-7(8)6-9;1-6(7)2-4-8-5-3-6;1-2-8-4-3-6(7)5-8;7-5-6-3-1-2-4-8-6;6-5(7)3-9-2-1-4(5)8;6*1-4(2)3;/h10H,6-9H2,1-5H3;12-13H,4-8H2,1-3H3;9,11H,5-8H2,1-4H3;8-9,11-12H,5-7H2,1-4H3;11H,6-9H2,1-5H3;8-9H,4-7H2,1-3H3;2*8,10-11H,4-7H2,1-3H3;8,10H,4-7H2,1-3H3;6-7H,2-5,9H2,1H3;7H,2-6,8H2,1H3;8H,2-5,7H2,1H3;6H,2-5,7H2,1H3;6H,1-5,7H2;4,9H,1-3,8H2;6*4H,1-3H3;1H4
InChIKeyHXGFXMLWBMBNAK-UHFFFAOYSA-N
MW2627.52 g/mol
LogP25.77
Rot. Bonds19

About N-tert-butylcyclopentanamine;N-tert-butyl-N',N'-diethylethane-1,2-diamine;1-tert-butyl-N,N-dimethylpiperidin-4-amine;N-tert-butyl-3-methylpiperidin-4-amine;N-tert-butylpiperidin-3-amine;N-tert-butylpiperidin-4-amine;3,3-difluoropiperidin-4-amine;1-ethyl-3-fluoropiperidin-4-amine;1-ethylpiperidin-3-amine;1-ethylpyrrolidin-3-amine;N-[(4-fluoropiperidin-4-yl)methyl]-2-methylpropan-2-amine;methane;2-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]propan-2-amine;4-methylpiperidin-4-amine;hexakis(2-methylpropane);3-[(2-methylpropan-2-yl)oxy]-1-azabicyclo[2.2.1]heptane;oxan-2-ylmethanamine

N-tert-butylcyclopentanamine;N-tert-butyl-N',N'-diethylethane-1,2-diamine;1-tert-butyl-N,N-dimethylpiperidin-4-amine;N-tert-butyl-3-methylpiperidin-4-amine;N-tert-butylpiperidin-3-amine;N-tert-butylpiperidin-4-amine;3,3-difluoropiperidin-4-amine;1-ethyl-3-fluoropiperidin-4-amine;1-ethylpiperidin-3-amine;1-ethylpyrrolidin-3-amine;N-[(4-fluoropiperidin-4-yl)methyl]-2-methylpropan-2-amine;methane;2-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]propan-2-amine;4-methylpiperidin-4-amine;hexakis(2-methylpropane);3-[(2-methylpropan-2-yl)oxy]-1-azabicyclo[2.2.1]heptane;oxan-2-ylmethanamine (PubChem CID 158614735) has the molecular formula C150H337F4N27O2 and a molecular weight of 2627.52 g/mol. Its IUPAC name is N-tert-butylcyclopentanamine;N-tert-butyl-N',N'-diethylethane-1,2-diamine;1-tert-butyl-N,N-dimethylpiperidin-4-amine;N-tert-butyl-3-methylpiperidin-4-amine;N-tert-butylpiperidin-3-amine;N-tert-butylpiperidin-4-amine;3,3-difluoropiperidin-4-amine;1-ethyl-3-fluoropiperidin-4-amine;1-ethylpiperidin-3-amine;1-ethylpyrrolidin-3-amine;N-[(4-fluoropiperidin-4-yl)methyl]-2-methylpropan-2-amine;methane;2-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]propan-2-amine;4-methylpiperidin-4-amine;hexakis(2-methylpropane);3-[(2-methylpropan-2-yl)oxy]-1-azabicyclo[2.2.1]heptane;oxan-2-ylmethanamine.

Molecular Properties

Compound NameN-tert-butylcyclopentanamine;N-tert-butyl-N',N'-diethylethane-1,2-diamine;1-tert-butyl-N,N-dimethylpiperidin-4-amine;N-tert-butyl-3-methylpiperidin-4-amine;N-tert-butylpiperidin-3-amine;N-tert-butylpiperidin-4-amine;3,3-difluoropiperidin-4-amine;1-ethyl-3-fluoropiperidin-4-amine;1-ethylpiperidin-3-amine;1-ethylpyrrolidin-3-amine;N-[(4-fluoropiperidin-4-yl)methyl]-2-methylpropan-2-amine;methane;2-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]propan-2-amine;4-methylpiperidin-4-amine;hexakis(2-methylpropane);3-[(2-methylpropan-2-yl)oxy]-1-azabicyclo[2.2.1]heptane;oxan-2-ylmethanamine
PubChem CID158614735
Molecular FormulaC150H337F4N27O2
Molecular Weight2627.52 g/mol
Exact Mass2625.70
IUPAC NameN-tert-butylcyclopentanamine;N-tert-butyl-N',N'-diethylethane-1,2-diamine;1-tert-butyl-N,N-dimethylpiperidin-4-amine;N-tert-butyl-3-methylpiperidin-4-amine;N-tert-butylpiperidin-3-amine;N-tert-butylpiperidin-4-amine;3,3-difluoropiperidin-4-amine;1-ethyl-3-fluoropiperidin-4-amine;1-ethylpiperidin-3-amine;1-ethylpyrrolidin-3-amine;N-[(4-fluoropiperidin-4-yl)methyl]-2-methylpropan-2-amine;methane;2-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]propan-2-amine;4-methylpiperidin-4-amine;hexakis(2-methylpropane);3-[(2-methylpropan-2-yl)oxy]-1-azabicyclo[2.2.1]heptane;oxan-2-ylmethanamine
SMILESC.CC(C)(C)NC1CCCC1.CC(C)(C)NC1CCCNC1.CC(C)(C)NC1CCNCC1.CC(C)(C)NCC1(F)CCNCC1.CC(C)(C)OC1CN2CCC1C2.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC1(N)CCNCC1.CC1CNCCC1NC(C)(C)C.CCN(CC)CCNC(C)(C)C.CCN1CCC(N)C(F)C1.CCN1CCC(N)C1.CCN1CCCC(N)C1.CN(C)C1CCN(C(C)(C)C)CC1.CN1CCC(CNC(C)(C)C)C1.NC1CCNCC1(F)F.NCC1CCCCO1
InChIInChI=1S/C11H24N2.C10H21FN2.2C10H22N2.C10H24N2.C10H19NO.2C9H20N2.C9H19N.C7H15FN2.C7H16N2.2C6H14N2.C6H13NO.C5H10F2N2.6C4H10.CH4/c1-11(2,3)13-8-6-10(7-9-13)12(4)5;1-9(2,3)13-8-10(11)4-6-12-7-5-10;1-10(2,3)11-7-9-5-6-12(4)8-9;1-8-7-11-6-5-9(8)12-10(2,3)4;1-6-12(7-2)9-8-11-10(3,4)5;1-10(2,3)12-9-7-11-5-4-8(9)6-11;1-9(2,3)11-8-4-6-10-7-5-8;1-9(2,3)11-8-5-4-6-10-7-8;1-9(2,3)10-8-6-4-5-7-8;1-2-10-4-3-7(9)6(8)5-10;1-2-9-5-3-4-7(8)6-9;1-6(7)2-4-8-5-3-6;1-2-8-4-3-6(7)5-8;7-5-6-3-1-2-4-8-6;6-5(7)3-9-2-1-4(5)8;6*1-4(2)3;/h10H,6-9H2,1-5H3;12-13H,4-8H2,1-3H3;9,11H,5-8H2,1-4H3;8-9,11-12H,5-7H2,1-4H3;11H,6-9H2,1-5H3;8-9H,4-7H2,1-3H3;2*8,10-11H,4-7H2,1-3H3;8,10H,4-7H2,1-3H3;6-7H,2-5,9H2,1H3;7H,2-6,8H2,1H3;8H,2-5,7H2,1H3;6H,2-5,7H2,1H3;6H,1-5,7H2;4,9H,1-3,8H2;6*4H,1-3H3;1H4
InChIKeyHXGFXMLWBMBNAK-UHFFFAOYSA-N
XLogP25.77
TPSA356.89 Ų
H-Bond Donors19
H-Bond Acceptors29
Rotatable Bonds19
Heavy Atoms183
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002627.52
LogP ≤ 525.77
H-Bond Donors ≤ 519
H-Bond Acceptors ≤ 1029

Analyze N-tert-butylcyclopentanamine;N-tert-butyl-N',N'-diethylethane-1,2-diamine;1-tert-butyl-N,N-dimethylpiperidin-4-amine;N-tert-butyl-3-methylpiperidin-4-amine;N-tert-butylpiperidin-3-amine;N-tert-butylpiperidin-4-amine;3,3-difluoropiperidin-4-amine;1-ethyl-3-fluoropiperidin-4-amine;1-ethylpiperidin-3-amine;1-ethylpyrrolidin-3-amine;N-[(4-fluoropiperidin-4-yl)methyl]-2-methylpropan-2-amine;methane;2-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]propan-2-amine;4-methylpiperidin-4-amine;hexakis(2-methylpropane);3-[(2-methylpropan-2-yl)oxy]-1-azabicyclo[2.2.1]heptane;oxan-2-ylmethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

CID 157818371
CID 157818371
3,3-difluoro-1-propan-2-ylpiperidine;4,4-difluoro-1-propan-2-ylpiperidine;3,3-dimethyl-1-propan-2-ylpiperidine;bis((3R)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine);(3S)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;3,3-dimethyl-1-propan-2-ylpyrrolidine;(3S)-3-fluoro-1-propan-2-ylpiperidine;3-methoxy-1-propan-2-ylpiperidine;3-methoxy-1-propan-2-ylpyrrolidine;4-methylmorpholine;1-methyl-4-propan-2-ylpiperazine;bis(3-methyl-1-propan-2-ylpiperidine);4-methyl-1-propan-2-ylpiperidine;bis(3-methyl-1-propan-2-ylpyrrolidine);(3S)-3-methyl-1-propan-2-ylpyrrolidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;1-propan-2-ylpiperidine;1-propan-2-yl-2-(trifluoromethyl)pyrrolidine;1-propan-2-yl-3-(trifluoromethyl)pyrrolidine;(2S)-1-propan-2-yl-2-(trifluoromethyl)pyrrolidine;(2R)-1-propan-2-yl-2-(trifluoromethyl)pyrrolidine
CID 158355162
4,4-difluoro-1-propan-2-ylpiperidine;N,1-dimethyl-N-propan-2-ylpiperidin-4-amine;1,4-di(propan-2-yl)piperazine;1-ethyl-4-propan-2-ylpiperazine;1-methyl-4-(2-methylpropyl)piperazine;1-methyl-4-(2-methylpropyl)piperidine;(1S,4S)-2-methyl-5-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;1-methyl-4-(2-propan-2-yloxyethyl)piperazine;1-methyl-4-propan-2-ylpiperazine;1-(2-methylpropyl)pyrrolidine;4-propan-2-ylmorpholine;1-(2-propan-2-yloxyethyl)piperazine;1-(2-propan-2-yloxyethyl)piperidine;1-(2-propan-2-yloxyethyl)pyrrolidine;1-propan-2-ylpiperazine;1-propan-2-ylpiperidine;4-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine
CID 158684961
CID 158838479
CID 158838479
4,4-difluoro-1-propan-2-ylpiperidine;N,1-dimethyl-N-propan-2-ylpiperidin-4-amine;1,4-di(propan-2-yl)piperazine;1-ethyl-4-propan-2-ylpiperazine;1-methyl-4-(2-methylpropyl)piperazine;1-methyl-4-(2-methylpropyl)piperidine;(1S,4S)-2-methyl-5-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;1-methyl-4-(2-propan-2-yloxyethyl)piperazine;1-methyl-4-propan-2-ylpiperazine;1-(2-methylpropyl)pyrrolidine;4-propan-2-ylmorpholine;1-(2-propan-2-yloxyethyl)piperidine;1-(2-propan-2-yloxyethyl)pyrrolidine;1-propan-2-ylpiperazine;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine
CID 159599369
2-cyclopropyl-4-propan-2-ylmorpholine;2,2-dimethyl-4-propan-2-ylmorpholine;(2S,6S)-2,6-dimethyl-4-propan-2-ylmorpholine;(2R,6R)-2,6-dimethyl-4-propan-2-ylmorpholine;(2R,6S)-2,6-dimethyl-4-propan-2-ylmorpholine;(2R)-2-ethyl-4-propan-2-ylmorpholine;bis((2R)-2-methyl-4-propan-2-ylmorpholine);bis((2S)-2-methyl-4-propan-2-ylmorpholine);2-methyl-4-propan-2-ylmorpholine;1-methyl-4-propan-2-ylpiperazine;3-methyl-1-propan-2-ylpiperazine;2-methyl-1-propan-2-ylpiperidine;bis(4-methyl-1-propan-2-ylpiperidine);2-methyl-1-propan-2-ylpyrrolidine;(2S)-2-methyl-1-propan-2-ylpyrrolidine;tris(1-propan-2-ylpiperidine);(3S)-1-propan-2-yl-3-(trifluoromethyl)piperidine;(3R)-1-propan-2-yl-3-(trifluoromethyl)piperidine;(3R)-1-propan-2-yl-3-(trifluoromethyl)pyrrolidine;(3S)-1-propan-2-yl-3-(trifluoromethyl)pyrrolidine
CID 160209125
2,2-dimethyl-4-propan-2-ylmorpholine;(2R)-2-ethyl-4-propan-2-ylmorpholine;(2R)-2-methyl-4-propan-2-ylmorpholine;(2S)-2-methyl-4-propan-2-ylmorpholine;1-methyl-4-propan-2-ylpiperazine;3-methyl-1-propan-2-ylpiperazine;2-methyl-1-propan-2-ylpiperidine;4-methyl-1-propan-2-ylpiperidine;4-propan-2-ylmorpholine;bis(1-propan-2-ylpiperidine);(2R)-4-propan-2-yl-2-(trifluoromethyl)morpholine;(2S)-4-propan-2-yl-2-(trifluoromethyl)morpholine;4-propan-2-yl-2-(trifluoromethyl)morpholine;1-propan-2-yl-4-(trifluoromethyl)piperidine;(3S)-1-propan-2-yl-3-(trifluoromethyl)piperidine;(3R)-1-propan-2-yl-3-(trifluoromethyl)piperidine;1-propan-2-yl-2-(trifluoromethyl)pyrrolidine;(2R)-1-propan-2-yl-2-(trifluoromethyl)pyrrolidine;(3S)-1-propan-2-yl-3-(trifluoromethyl)pyrrolidine;(3R)-1-propan-2-yl-3-(trifluoromethyl)pyrrolidine
CID 161285337
4-Fluoro-1-propan-2-ylpiperidine;1-methyl-4-(propan-2-yloxymethyl)piperazine;1-methyl-4-(propan-2-yloxymethyl)piperidine;bis(1-methyl-3-(propan-2-yloxymethyl)pyrrolidine);3-methyl-1-propan-2-ylpyrrolidine;4-(propan-2-yloxymethyl)morpholine;1-(propan-2-yloxymethyl)piperazine;1-(propan-2-yloxymethyl)piperidine;1-propan-2-ylpyrrolidine
CID 159713432
CID 160269110
CID 160269110
CID 161015127
CID 161015127
1-butyl-4-tert-butylpiperazine;1-tert-butyl-N,N-diethylpiperidin-4-amine;N-tert-butyl-N',N'-dimethylpropane-1,3-diamine;1-tert-butyl-4-ethylpiperazine;N-tert-butyl-1-ethylpiperidin-4-amine;1-tert-butyl-4-(2-methoxyethyl)piperazine;4-(4,4-dimethylpentyl)morpholine;bis(1-(4,4-dimethylpentyl)pyrrolidine);4-(2,2-dimethylpropyl)-1-ethylpiperidine;4-(2,2-dimethylpropyl)piperidine;1-ethyl-3-fluoro-4-[(2-methylpropan-2-yl)oxy]piperidine;1-ethyl-3-[(2-methylpropan-2-yl)oxy]piperidine;1-methyl-3-[(2-methylpropan-2-yl)oxy]azetidine;4-methyl-4-[(2-methylpropan-2-yl)oxy]piperidine;2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;N,N,4,4-tetramethylpentan-1-amine;N,4,4-trimethylpentan-1-amine
CID 161642596

Frequently Asked Questions

What is the IUPAC name of N-tert-butylcyclopentanamine;N-tert-butyl-N',N'-diethylethane-1,2-diamine;1-tert-butyl-N,N-dimethylpiperidin-4-amine;N-tert-butyl-3-methylpiperidin-4-amine;N-tert-butylpiperidin-3-amine;N-tert-butylpiperidin-4-amine;3,3-difluoropiperidin-4-amine;1-ethyl-3-fluoropiperidin-4-amine;1-ethylpiperidin-3-amine;1-ethylpyrrolidin-3-amine;N-[(4-fluoropiperidin-4-yl)methyl]-2-methylpropan-2-amine;methane;2-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]propan-2-amine;4-methylpiperidin-4-amine;hexakis(2-methylpropane);3-[(2-methylpropan-2-yl)oxy]-1-azabicyclo[2.2.1]heptane;oxan-2-ylmethanamine?
The IUPAC name of N-tert-butylcyclopentanamine;N-tert-butyl-N',N'-diethylethane-1,2-diamine;1-tert-butyl-N,N-dimethylpiperidin-4-amine;N-tert-butyl-3-methylpiperidin-4-amine;N-tert-butylpiperidin-3-amine;N-tert-butylpiperidin-4-amine;3,3-difluoropiperidin-4-amine;1-ethyl-3-fluoropiperidin-4-amine;1-ethylpiperidin-3-amine;1-ethylpyrrolidin-3-amine;N-[(4-fluoropiperidin-4-yl)methyl]-2-methylpropan-2-amine;methane;2-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]propan-2-amine;4-methylpiperidin-4-amine;hexakis(2-methylpropane);3-[(2-methylpropan-2-yl)oxy]-1-azabicyclo[2.2.1]heptane;oxan-2-ylmethanamine (CID 158614735) is N-tert-butylcyclopentanamine;N-tert-butyl-N',N'-diethylethane-1,2-diamine;1-tert-butyl-N,N-dimethylpiperidin-4-amine;N-tert-butyl-3-methylpiperidin-4-amine;N-tert-butylpiperidin-3-amine;N-tert-butylpiperidin-4-amine;3,3-difluoropiperidin-4-amine;1-ethyl-3-fluoropiperidin-4-amine;1-ethylpiperidin-3-amine;1-ethylpyrrolidin-3-amine;N-[(4-fluoropiperidin-4-yl)methyl]-2-methylpropan-2-amine;methane;2-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]propan-2-amine;4-methylpiperidin-4-amine;hexakis(2-methylpropane);3-[(2-methylpropan-2-yl)oxy]-1-azabicyclo[2.2.1]heptane;oxan-2-ylmethanamine.
What is the SMILES notation for N-tert-butylcyclopentanamine;N-tert-butyl-N',N'-diethylethane-1,2-diamine;1-tert-butyl-N,N-dimethylpiperidin-4-amine;N-tert-butyl-3-methylpiperidin-4-amine;N-tert-butylpiperidin-3-amine;N-tert-butylpiperidin-4-amine;3,3-difluoropiperidin-4-amine;1-ethyl-3-fluoropiperidin-4-amine;1-ethylpiperidin-3-amine;1-ethylpyrrolidin-3-amine;N-[(4-fluoropiperidin-4-yl)methyl]-2-methylpropan-2-amine;methane;2-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]propan-2-amine;4-methylpiperidin-4-amine;hexakis(2-methylpropane);3-[(2-methylpropan-2-yl)oxy]-1-azabicyclo[2.2.1]heptane;oxan-2-ylmethanamine?
The canonical SMILES for N-tert-butylcyclopentanamine;N-tert-butyl-N',N'-diethylethane-1,2-diamine;1-tert-butyl-N,N-dimethylpiperidin-4-amine;N-tert-butyl-3-methylpiperidin-4-amine;N-tert-butylpiperidin-3-amine;N-tert-butylpiperidin-4-amine;3,3-difluoropiperidin-4-amine;1-ethyl-3-fluoropiperidin-4-amine;1-ethylpiperidin-3-amine;1-ethylpyrrolidin-3-amine;N-[(4-fluoropiperidin-4-yl)methyl]-2-methylpropan-2-amine;methane;2-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]propan-2-amine;4-methylpiperidin-4-amine;hexakis(2-methylpropane);3-[(2-methylpropan-2-yl)oxy]-1-azabicyclo[2.2.1]heptane;oxan-2-ylmethanamine is C.CC(C)(C)NC1CCCC1.CC(C)(C)NC1CCCNC1.CC(C)(C)NC1CCNCC1.CC(C)(C)NCC1(F)CCNCC1.CC(C)(C)OC1CN2CCC1C2.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC1(N)CCNCC1.CC1CNCCC1NC(C)(C)C.CCN(CC)CCNC(C)(C)C.CCN1CCC(N)C(F)C1.CCN1CCC(N)C1.CCN1CCCC(N)C1.CN(C)C1CCN(C(C)(C)C)CC1.CN1CCC(CNC(C)(C)C)C1.NC1CCNCC1(F)F.NCC1CCCCO1.
What is the InChIKey of N-tert-butylcyclopentanamine;N-tert-butyl-N',N'-diethylethane-1,2-diamine;1-tert-butyl-N,N-dimethylpiperidin-4-amine;N-tert-butyl-3-methylpiperidin-4-amine;N-tert-butylpiperidin-3-amine;N-tert-butylpiperidin-4-amine;3,3-difluoropiperidin-4-amine;1-ethyl-3-fluoropiperidin-4-amine;1-ethylpiperidin-3-amine;1-ethylpyrrolidin-3-amine;N-[(4-fluoropiperidin-4-yl)methyl]-2-methylpropan-2-amine;methane;2-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]propan-2-amine;4-methylpiperidin-4-amine;hexakis(2-methylpropane);3-[(2-methylpropan-2-yl)oxy]-1-azabicyclo[2.2.1]heptane;oxan-2-ylmethanamine?
The InChIKey is HXGFXMLWBMBNAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2.C10H21FN2.2C10H22N2.C10H24N2.C10H19NO.2C9H20N2.C9H19N.C7H15FN2.C7H16N2.2C6H14N2.C6H13NO.C5H10F2N2.6C4H10.CH4/c1-11(2,3)13-8-6-10(7-9-13)12(4)5;1-9(2,3)13-8-10(11)4-6-12-7-5-10;1-10(2,3)11-7-9-5-6-12(4)8-9;1-8-7-11-6-5-9(8)12-10(2,3)4;1-6-12(7-2)9-8-11-10(3,4)5;1-10(2,3)12-9-7-11-5-4-8(9)6-11;1-9(2,3)11-8-4-6-10-7-5-8;1-9(2,3)11-8-5-4-6-10-7-8;1-9(2,3)10-8-6-4-5-7-8;1-2-10-4-3-7(9)6(8)5-10;1-2-9-5-3-4-7(8)6-9;1-6(7)2-4-8-5-3-6;1-2-8-4-3-6(7)5-8;7-5-6-3-1-2-4-8-6;6-5(7)3-9-2-1-4(5)8;6*1-4(2)3;/h10H,6-9H2,1-5H3;12-13H,4-8H2,1-3H3;9,11H,5-8H2,1-4H3;8-9,11-12H,5-7H2,1-4H3;11H,6-9H2,1-5H3;8-9H,4-7H2,1-3H3;2*8,10-11H,4-7H2,1-3H3;8,10H,4-7H2,1-3H3;6-7H,2-5,9H2,1H3;7H,2-6,8H2,1H3;8H,2-5,7H2,1H3;6H,2-5,7H2,1H3;6H,1-5,7H2;4,9H,1-3,8H2;6*4H,1-3H3;1H4.
What are the key properties of N-tert-butylcyclopentanamine;N-tert-butyl-N',N'-diethylethane-1,2-diamine;1-tert-butyl-N,N-dimethylpiperidin-4-amine;N-tert-butyl-3-methylpiperidin-4-amine;N-tert-butylpiperidin-3-amine;N-tert-butylpiperidin-4-amine;3,3-difluoropiperidin-4-amine;1-ethyl-3-fluoropiperidin-4-amine;1-ethylpiperidin-3-amine;1-ethylpyrrolidin-3-amine;N-[(4-fluoropiperidin-4-yl)methyl]-2-methylpropan-2-amine;methane;2-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]propan-2-amine;4-methylpiperidin-4-amine;hexakis(2-methylpropane);3-[(2-methylpropan-2-yl)oxy]-1-azabicyclo[2.2.1]heptane;oxan-2-ylmethanamine?
N-tert-butylcyclopentanamine;N-tert-butyl-N',N'-diethylethane-1,2-diamine;1-tert-butyl-N,N-dimethylpiperidin-4-amine;N-tert-butyl-3-methylpiperidin-4-amine;N-tert-butylpiperidin-3-amine;N-tert-butylpiperidin-4-amine;3,3-difluoropiperidin-4-amine;1-ethyl-3-fluoropiperidin-4-amine;1-ethylpiperidin-3-amine;1-ethylpyrrolidin-3-amine;N-[(4-fluoropiperidin-4-yl)methyl]-2-methylpropan-2-amine;methane;2-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]propan-2-amine;4-methylpiperidin-4-amine;hexakis(2-methylpropane);3-[(2-methylpropan-2-yl)oxy]-1-azabicyclo[2.2.1]heptane;oxan-2-ylmethanamine has a molecular weight of 2627.52 g/mol, XLogP of 25.77, 19 rotatable bonds, 19 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butylcyclopentanamine;N-tert-butyl-N',N'-diethylethane-1,2-diamine;1-tert-butyl-N,N-dimethylpiperidin-4-amine;N-tert-butyl-3-methylpiperidin-4-amine;N-tert-butylpiperidin-3-amine;N-tert-butylpiperidin-4-amine;3,3-difluoropiperidin-4-amine;1-ethyl-3-fluoropiperidin-4-amine;1-ethylpiperidin-3-amine;1-ethylpyrrolidin-3-amine;N-[(4-fluoropiperidin-4-yl)methyl]-2-methylpropan-2-amine;methane;2-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]propan-2-amine;4-methylpiperidin-4-amine;hexakis(2-methylpropane);3-[(2-methylpropan-2-yl)oxy]-1-azabicyclo[2.2.1]heptane;oxan-2-ylmethanamine is sourced from PubChem (CID 158614735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).