N-cyclohexyl-N,3-dimethylbutanamide;cyclohexyl 3-methylbutanoate;N,3-dimethyl-N-(3-methylbutyl)butanamide;1,1-dimethyl-3-(3-methylbutyl)cyclopentane;1-fluoro-4-(4-methylpentyl)benzene;3-methylbutyl 3-methylbutanoate;1-(3-methylbutyl)piperazine;1-(3-methylbutyl)piperidine;methyl 3-methylbutanoate;3-methyl-1-(4-methylpiperazin-1-yl)butan-1-one;3-methyl-1-(6-methyl-3-pyridinyl)butan-1-one;4-methylpentylbenzene;3-(4-methylpentyl)pyridine;1-(4-methylpentyl)-4-(trifluoromethyl)benzene;(4-methylphenyl) 3-methylbutanoate;propan-2-yl 3-methylbutanoate

C170H299F4N9O14 — CID 157223997

IUPACN-cyclohexyl-N,3-dimethylbutanamide;cyclohexyl 3-methylbutanoate;N,3-dimethyl-N-(3-methylbutyl)butanamide;1,1-dimethyl-3-(3-methylbutyl)cyclopentane;1-fluoro-4-(4-methylpentyl)benzene;3-methylbutyl 3-methylbutanoate;1-(3-methylbutyl)piperazine;1-(3-methylbutyl)piperidine;methyl 3-methylbutanoate;3-methyl-1-(4-methylpiperazin-1-yl)butan-1-one;3-methyl-1-(6-methyl-3-pyridinyl)butan-1-one;4-methylpentylbenzene;3-(4-methylpentyl)pyridine;1-(4-methylpentyl)-4-(trifluoromethyl)benzene;(4-methylphenyl) 3-methylbutanoate;propan-2-yl 3-methylbutanoate
SMILESCC(C)CC(=O)N(C)C1CCCCC1.CC(C)CC(=O)N1CCN(C)CC1.CC(C)CC(=O)OC(C)C.CC(C)CC(=O)OC1CCCCC1.CC(C)CCC1CCC(C)(C)C1.CC(C)CCCc1ccc(C(F)(F)F)cc1.CC(C)CCCc1ccc(F)cc1.CC(C)CCCc1ccccc1.CC(C)CCCc1cccnc1.CC(C)CCN(C)C(=O)CC(C)C.CC(C)CCN1CCCCC1.CC(C)CCN1CCNCC1.CC(C)CCOC(=O)CC(C)C.COC(=O)CC(C)C.Cc1ccc(C(=O)CC(C)C)cn1.Cc1ccc(OC(=O)CC(C)C)cc1
InChIInChI=1S/C13H17F3.C12H17F.C12H23NO.C12H16O2.C12H24.C12H18.C11H15NO.C11H23NO.C11H17N.C11H20O2.C10H20N2O.C10H21N.C10H20O2.C9H20N2.C8H16O2.C6H12O2/c1-10(2)4-3-5-11-6-8-12(9-7-11)13(14,15)16;1-10(2)4-3-5-11-6-8-12(13)9-7-11;1-10(2)9-12(14)13(3)11-7-5-4-6-8-11;1-9(2)8-12(13)14-11-6-4-10(3)5-7-11;1-10(2)5-6-11-7-8-12(3,4)9-11;1-11(2)7-6-10-12-8-4-3-5-9-12;1-8(2)6-11(13)10-5-4-9(3)12-7-10;1-9(2)6-7-12(5)11(13)8-10(3)4;1-10(2)5-3-6-11-7-4-8-12-9-11;1-9(2)8-11(12)13-10-6-4-3-5-7-10;1-9(2)8-10(13)12-6-4-11(3)5-7-12;1-10(2)6-9-11-7-4-3-5-8-11;1-8(2)5-6-12-10(11)7-9(3)4;1-9(2)3-6-11-7-4-10-5-8-11;1-6(2)5-8(9)10-7(3)4;1-5(2)4-6(7)8-3/h6-10H,3-5H2,1-2H3;6-10H,3-5H2,1-2H3;10-11H,4-9H2,1-3H3;4-7,9H,8H2,1-3H3;10-11H,5-9H2,1-4H3;3-5,8-9,11H,6-7,10H2,1-2H3;4-5,7-8H,6H2,1-3H3;9-10H,6-8H2,1-5H3;4,7-10H,3,5-6H2,1-2H3;9-10H,3-8H2,1-2H3;9H,4-8H2,1-3H3;10H,3-9H2,1-2H3;8-9H,5-7H2,1-4H3;9-10H,3-8H2,1-2H3;6-7H,5H2,1-4H3;5H,4H2,1-3H3
InChIKeyATIBXKUSUHZFMV-UHFFFAOYSA-N
MW2769.30 g/mol
LogP43.37
Rot. Bonds54

About N-cyclohexyl-N,3-dimethylbutanamide;cyclohexyl 3-methylbutanoate;N,3-dimethyl-N-(3-methylbutyl)butanamide;1,1-dimethyl-3-(3-methylbutyl)cyclopentane;1-fluoro-4-(4-methylpentyl)benzene;3-methylbutyl 3-methylbutanoate;1-(3-methylbutyl)piperazine;1-(3-methylbutyl)piperidine;methyl 3-methylbutanoate;3-methyl-1-(4-methylpiperazin-1-yl)butan-1-one;3-methyl-1-(6-methyl-3-pyridinyl)butan-1-one;4-methylpentylbenzene;3-(4-methylpentyl)pyridine;1-(4-methylpentyl)-4-(trifluoromethyl)benzene;(4-methylphenyl) 3-methylbutanoate;propan-2-yl 3-methylbutanoate

N-cyclohexyl-N,3-dimethylbutanamide;cyclohexyl 3-methylbutanoate;N,3-dimethyl-N-(3-methylbutyl)butanamide;1,1-dimethyl-3-(3-methylbutyl)cyclopentane;1-fluoro-4-(4-methylpentyl)benzene;3-methylbutyl 3-methylbutanoate;1-(3-methylbutyl)piperazine;1-(3-methylbutyl)piperidine;methyl 3-methylbutanoate;3-methyl-1-(4-methylpiperazin-1-yl)butan-1-one;3-methyl-1-(6-methyl-3-pyridinyl)butan-1-one;4-methylpentylbenzene;3-(4-methylpentyl)pyridine;1-(4-methylpentyl)-4-(trifluoromethyl)benzene;(4-methylphenyl) 3-methylbutanoate;propan-2-yl 3-methylbutanoate (PubChem CID 157223997) has the molecular formula C170H299F4N9O14 and a molecular weight of 2769.30 g/mol. Its IUPAC name is N-cyclohexyl-N,3-dimethylbutanamide;cyclohexyl 3-methylbutanoate;N,3-dimethyl-N-(3-methylbutyl)butanamide;1,1-dimethyl-3-(3-methylbutyl)cyclopentane;1-fluoro-4-(4-methylpentyl)benzene;3-methylbutyl 3-methylbutanoate;1-(3-methylbutyl)piperazine;1-(3-methylbutyl)piperidine;methyl 3-methylbutanoate;3-methyl-1-(4-methylpiperazin-1-yl)butan-1-one;3-methyl-1-(6-methyl-3-pyridinyl)butan-1-one;4-methylpentylbenzene;3-(4-methylpentyl)pyridine;1-(4-methylpentyl)-4-(trifluoromethyl)benzene;(4-methylphenyl) 3-methylbutanoate;propan-2-yl 3-methylbutanoate.

Molecular Properties

Compound NameN-cyclohexyl-N,3-dimethylbutanamide;cyclohexyl 3-methylbutanoate;N,3-dimethyl-N-(3-methylbutyl)butanamide;1,1-dimethyl-3-(3-methylbutyl)cyclopentane;1-fluoro-4-(4-methylpentyl)benzene;3-methylbutyl 3-methylbutanoate;1-(3-methylbutyl)piperazine;1-(3-methylbutyl)piperidine;methyl 3-methylbutanoate;3-methyl-1-(4-methylpiperazin-1-yl)butan-1-one;3-methyl-1-(6-methyl-3-pyridinyl)butan-1-one;4-methylpentylbenzene;3-(4-methylpentyl)pyridine;1-(4-methylpentyl)-4-(trifluoromethyl)benzene;(4-methylphenyl) 3-methylbutanoate;propan-2-yl 3-methylbutanoate
PubChem CID157223997
Molecular FormulaC170H299F4N9O14
Molecular Weight2769.30 g/mol
Exact Mass2767.29
IUPAC NameN-cyclohexyl-N,3-dimethylbutanamide;cyclohexyl 3-methylbutanoate;N,3-dimethyl-N-(3-methylbutyl)butanamide;1,1-dimethyl-3-(3-methylbutyl)cyclopentane;1-fluoro-4-(4-methylpentyl)benzene;3-methylbutyl 3-methylbutanoate;1-(3-methylbutyl)piperazine;1-(3-methylbutyl)piperidine;methyl 3-methylbutanoate;3-methyl-1-(4-methylpiperazin-1-yl)butan-1-one;3-methyl-1-(6-methyl-3-pyridinyl)butan-1-one;4-methylpentylbenzene;3-(4-methylpentyl)pyridine;1-(4-methylpentyl)-4-(trifluoromethyl)benzene;(4-methylphenyl) 3-methylbutanoate;propan-2-yl 3-methylbutanoate
SMILESCC(C)CC(=O)N(C)C1CCCCC1.CC(C)CC(=O)N1CCN(C)CC1.CC(C)CC(=O)OC(C)C.CC(C)CC(=O)OC1CCCCC1.CC(C)CCC1CCC(C)(C)C1.CC(C)CCCc1ccc(C(F)(F)F)cc1.CC(C)CCCc1ccc(F)cc1.CC(C)CCCc1ccccc1.CC(C)CCCc1cccnc1.CC(C)CCN(C)C(=O)CC(C)C.CC(C)CCN1CCCCC1.CC(C)CCN1CCNCC1.CC(C)CCOC(=O)CC(C)C.COC(=O)CC(C)C.Cc1ccc(C(=O)CC(C)C)cn1.Cc1ccc(OC(=O)CC(C)C)cc1
InChIInChI=1S/C13H17F3.C12H17F.C12H23NO.C12H16O2.C12H24.C12H18.C11H15NO.C11H23NO.C11H17N.C11H20O2.C10H20N2O.C10H21N.C10H20O2.C9H20N2.C8H16O2.C6H12O2/c1-10(2)4-3-5-11-6-8-12(9-7-11)13(14,15)16;1-10(2)4-3-5-11-6-8-12(13)9-7-11;1-10(2)9-12(14)13(3)11-7-5-4-6-8-11;1-9(2)8-12(13)14-11-6-4-10(3)5-7-11;1-10(2)5-6-11-7-8-12(3,4)9-11;1-11(2)7-6-10-12-8-4-3-5-9-12;1-8(2)6-11(13)10-5-4-9(3)12-7-10;1-9(2)6-7-12(5)11(13)8-10(3)4;1-10(2)5-3-6-11-7-4-8-12-9-11;1-9(2)8-11(12)13-10-6-4-3-5-7-10;1-9(2)8-10(13)12-6-4-11(3)5-7-12;1-10(2)6-9-11-7-4-3-5-8-11;1-8(2)5-6-12-10(11)7-9(3)4;1-9(2)3-6-11-7-4-10-5-8-11;1-6(2)5-8(9)10-7(3)4;1-5(2)4-6(7)8-3/h6-10H,3-5H2,1-2H3;6-10H,3-5H2,1-2H3;10-11H,4-9H2,1-3H3;4-7,9H,8H2,1-3H3;10-11H,5-9H2,1-4H3;3-5,8-9,11H,6-7,10H2,1-2H3;4-5,7-8H,6H2,1-3H3;9-10H,6-8H2,1-5H3;4,7-10H,3,5-6H2,1-2H3;9-10H,3-8H2,1-2H3;9H,4-8H2,1-3H3;10H,3-9H2,1-2H3;8-9H,5-7H2,1-4H3;9-10H,3-8H2,1-2H3;6-7H,5H2,1-4H3;5H,4H2,1-3H3
InChIKeyATIBXKUSUHZFMV-UHFFFAOYSA-N
XLogP43.37
TPSA257.03 Ų
H-Bond Donors1
H-Bond Acceptors20
Rotatable Bonds54
Heavy Atoms197
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002769.30
LogP ≤ 543.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1020

Computed Properties (RDKit)

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

Analyze N-cyclohexyl-N,3-dimethylbutanamide;cyclohexyl 3-methylbutanoate;N,3-dimethyl-N-(3-methylbutyl)butanamide;1,1-dimethyl-3-(3-methylbutyl)cyclopentane;1-fluoro-4-(4-methylpentyl)benzene;3-methylbutyl 3-methylbutanoate;1-(3-methylbutyl)piperazine;1-(3-methylbutyl)piperidine;methyl 3-methylbutanoate;3-methyl-1-(4-methylpiperazin-1-yl)butan-1-one;3-methyl-1-(6-methyl-3-pyridinyl)butan-1-one;4-methylpentylbenzene;3-(4-methylpentyl)pyridine;1-(4-methylpentyl)-4-(trifluoromethyl)benzene;(4-methylphenyl) 3-methylbutanoate;propan-2-yl 3-methylbutanoate with MolForge

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Related Compounds

N-(1-(4-fluorobenzyl)piperidin-4-yl)-5-(4-(4-(trifluoromethyl) phenoxy)piperidine-1-carbonyl)picolinamide
CID 66710492
6-(4-(4-acetylphenoxy) piperidine-1-carbonyl)-N-(1-(4-fluorobenzyl)piperidin-4-yl)nicotinamide
CID 66710670
N-((cis)-4-(4-cyano-3-fluorophenoxy) cyclohexyl)-5-(4-(4-(trifluoromethyl) phenoxy)piperidine-1-carbonyl)picolinamide
CID 122486204
N-((trans)-3-fluoro-1-(4-(trifluoromethoxy)benzyl)piperidin-4-yl)-5-(4-(4-(methylsulfonyl)benzoyl)piperidine-1-carbonyl)picolinamide
CID 146676206
N-((trans)-3-fluoro-1-(4-(trifluoromethoxy)benzyl)piperidin-4-yl)-5-(4-(4-(methylsulfonyl)phenoxy)piperidine-1-carbonyl)picolinamide
CID 146676208
N-[1-[[4,4-difluoro-5-[(3-methyl-1-phenylmethoxybutan-2-yl)amino]-3,5-dioxo-1-(4-phenylmethoxyphenyl)pentan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]-6-(morpholine-4-carbonyl)pyridine-3-carboxamide
CID 57196706
5-[4-(4-methylbenzoyl)piperidine-1-carbonyl]-N-[4-[4-(trifluoromethyl)phenoxy]cyclohexyl]pyridine-2-carboxamide
CID 58073572
3-[[4-[(4-Tert-butylphenyl)-[6-[4-(trifluoromethyl)phenyl]-3-pyridinyl]methoxy]benzoyl]amino]propanoic acid;methyl 3-[[4-[(4-tert-butylphenyl)-[6-[4-(trifluoromethyl)phenyl]-3-pyridinyl]methoxy]benzoyl]amino]propanoate
CID 87417609
N-[(3S,4R)-3-fluoro-1-[[4-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]-6-[4-(4-methoxybenzoyl)piperidine-1-carbonyl]pyridine-3-carboxamide
CID 89737786
6-[4-(4-acetylphenoxy)piperidine-1-carbonyl]-N-[(3R,4R)-3-fluoro-1-[[4-(trifluoromethoxy)phenyl]methyl]piperidin-4-yl]pyridine-3-carboxamide
CID 89737985
N-[(3R,4R)-3-fluoro-1-[[4-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]-6-[4-(4-methoxybenzoyl)piperidine-1-carbonyl]pyridine-3-carboxamide
CID 117796330
6-[[4-(2,4-difluorophenoxy)piperidin-1-yl]methyl]-N-[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]pyridine-3-carboxamide
CID 123228129

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N,3-dimethylbutanamide;cyclohexyl 3-methylbutanoate;N,3-dimethyl-N-(3-methylbutyl)butanamide;1,1-dimethyl-3-(3-methylbutyl)cyclopentane;1-fluoro-4-(4-methylpentyl)benzene;3-methylbutyl 3-methylbutanoate;1-(3-methylbutyl)piperazine;1-(3-methylbutyl)piperidine;methyl 3-methylbutanoate;3-methyl-1-(4-methylpiperazin-1-yl)butan-1-one;3-methyl-1-(6-methyl-3-pyridinyl)butan-1-one;4-methylpentylbenzene;3-(4-methylpentyl)pyridine;1-(4-methylpentyl)-4-(trifluoromethyl)benzene;(4-methylphenyl) 3-methylbutanoate;propan-2-yl 3-methylbutanoate?
The IUPAC name of N-cyclohexyl-N,3-dimethylbutanamide;cyclohexyl 3-methylbutanoate;N,3-dimethyl-N-(3-methylbutyl)butanamide;1,1-dimethyl-3-(3-methylbutyl)cyclopentane;1-fluoro-4-(4-methylpentyl)benzene;3-methylbutyl 3-methylbutanoate;1-(3-methylbutyl)piperazine;1-(3-methylbutyl)piperidine;methyl 3-methylbutanoate;3-methyl-1-(4-methylpiperazin-1-yl)butan-1-one;3-methyl-1-(6-methyl-3-pyridinyl)butan-1-one;4-methylpentylbenzene;3-(4-methylpentyl)pyridine;1-(4-methylpentyl)-4-(trifluoromethyl)benzene;(4-methylphenyl) 3-methylbutanoate;propan-2-yl 3-methylbutanoate (CID 157223997) is N-cyclohexyl-N,3-dimethylbutanamide;cyclohexyl 3-methylbutanoate;N,3-dimethyl-N-(3-methylbutyl)butanamide;1,1-dimethyl-3-(3-methylbutyl)cyclopentane;1-fluoro-4-(4-methylpentyl)benzene;3-methylbutyl 3-methylbutanoate;1-(3-methylbutyl)piperazine;1-(3-methylbutyl)piperidine;methyl 3-methylbutanoate;3-methyl-1-(4-methylpiperazin-1-yl)butan-1-one;3-methyl-1-(6-methyl-3-pyridinyl)butan-1-one;4-methylpentylbenzene;3-(4-methylpentyl)pyridine;1-(4-methylpentyl)-4-(trifluoromethyl)benzene;(4-methylphenyl) 3-methylbutanoate;propan-2-yl 3-methylbutanoate.
What is the SMILES notation for N-cyclohexyl-N,3-dimethylbutanamide;cyclohexyl 3-methylbutanoate;N,3-dimethyl-N-(3-methylbutyl)butanamide;1,1-dimethyl-3-(3-methylbutyl)cyclopentane;1-fluoro-4-(4-methylpentyl)benzene;3-methylbutyl 3-methylbutanoate;1-(3-methylbutyl)piperazine;1-(3-methylbutyl)piperidine;methyl 3-methylbutanoate;3-methyl-1-(4-methylpiperazin-1-yl)butan-1-one;3-methyl-1-(6-methyl-3-pyridinyl)butan-1-one;4-methylpentylbenzene;3-(4-methylpentyl)pyridine;1-(4-methylpentyl)-4-(trifluoromethyl)benzene;(4-methylphenyl) 3-methylbutanoate;propan-2-yl 3-methylbutanoate?
The canonical SMILES for N-cyclohexyl-N,3-dimethylbutanamide;cyclohexyl 3-methylbutanoate;N,3-dimethyl-N-(3-methylbutyl)butanamide;1,1-dimethyl-3-(3-methylbutyl)cyclopentane;1-fluoro-4-(4-methylpentyl)benzene;3-methylbutyl 3-methylbutanoate;1-(3-methylbutyl)piperazine;1-(3-methylbutyl)piperidine;methyl 3-methylbutanoate;3-methyl-1-(4-methylpiperazin-1-yl)butan-1-one;3-methyl-1-(6-methyl-3-pyridinyl)butan-1-one;4-methylpentylbenzene;3-(4-methylpentyl)pyridine;1-(4-methylpentyl)-4-(trifluoromethyl)benzene;(4-methylphenyl) 3-methylbutanoate;propan-2-yl 3-methylbutanoate is CC(C)CC(=O)N(C)C1CCCCC1.CC(C)CC(=O)N1CCN(C)CC1.CC(C)CC(=O)OC(C)C.CC(C)CC(=O)OC1CCCCC1.CC(C)CCC1CCC(C)(C)C1.CC(C)CCCc1ccc(C(F)(F)F)cc1.CC(C)CCCc1ccc(F)cc1.CC(C)CCCc1ccccc1.CC(C)CCCc1cccnc1.CC(C)CCN(C)C(=O)CC(C)C.CC(C)CCN1CCCCC1.CC(C)CCN1CCNCC1.CC(C)CCOC(=O)CC(C)C.COC(=O)CC(C)C.Cc1ccc(C(=O)CC(C)C)cn1.Cc1ccc(OC(=O)CC(C)C)cc1.
What is the InChIKey of N-cyclohexyl-N,3-dimethylbutanamide;cyclohexyl 3-methylbutanoate;N,3-dimethyl-N-(3-methylbutyl)butanamide;1,1-dimethyl-3-(3-methylbutyl)cyclopentane;1-fluoro-4-(4-methylpentyl)benzene;3-methylbutyl 3-methylbutanoate;1-(3-methylbutyl)piperazine;1-(3-methylbutyl)piperidine;methyl 3-methylbutanoate;3-methyl-1-(4-methylpiperazin-1-yl)butan-1-one;3-methyl-1-(6-methyl-3-pyridinyl)butan-1-one;4-methylpentylbenzene;3-(4-methylpentyl)pyridine;1-(4-methylpentyl)-4-(trifluoromethyl)benzene;(4-methylphenyl) 3-methylbutanoate;propan-2-yl 3-methylbutanoate?
The InChIKey is ATIBXKUSUHZFMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17F3.C12H17F.C12H23NO.C12H16O2.C12H24.C12H18.C11H15NO.C11H23NO.C11H17N.C11H20O2.C10H20N2O.C10H21N.C10H20O2.C9H20N2.C8H16O2.C6H12O2/c1-10(2)4-3-5-11-6-8-12(9-7-11)13(14,15)16;1-10(2)4-3-5-11-6-8-12(13)9-7-11;1-10(2)9-12(14)13(3)11-7-5-4-6-8-11;1-9(2)8-12(13)14-11-6-4-10(3)5-7-11;1-10(2)5-6-11-7-8-12(3,4)9-11;1-11(2)7-6-10-12-8-4-3-5-9-12;1-8(2)6-11(13)10-5-4-9(3)12-7-10;1-9(2)6-7-12(5)11(13)8-10(3)4;1-10(2)5-3-6-11-7-4-8-12-9-11;1-9(2)8-11(12)13-10-6-4-3-5-7-10;1-9(2)8-10(13)12-6-4-11(3)5-7-12;1-10(2)6-9-11-7-4-3-5-8-11;1-8(2)5-6-12-10(11)7-9(3)4;1-9(2)3-6-11-7-4-10-5-8-11;1-6(2)5-8(9)10-7(3)4;1-5(2)4-6(7)8-3/h6-10H,3-5H2,1-2H3;6-10H,3-5H2,1-2H3;10-11H,4-9H2,1-3H3;4-7,9H,8H2,1-3H3;10-11H,5-9H2,1-4H3;3-5,8-9,11H,6-7,10H2,1-2H3;4-5,7-8H,6H2,1-3H3;9-10H,6-8H2,1-5H3;4,7-10H,3,5-6H2,1-2H3;9-10H,3-8H2,1-2H3;9H,4-8H2,1-3H3;10H,3-9H2,1-2H3;8-9H,5-7H2,1-4H3;9-10H,3-8H2,1-2H3;6-7H,5H2,1-4H3;5H,4H2,1-3H3.
What are the key properties of N-cyclohexyl-N,3-dimethylbutanamide;cyclohexyl 3-methylbutanoate;N,3-dimethyl-N-(3-methylbutyl)butanamide;1,1-dimethyl-3-(3-methylbutyl)cyclopentane;1-fluoro-4-(4-methylpentyl)benzene;3-methylbutyl 3-methylbutanoate;1-(3-methylbutyl)piperazine;1-(3-methylbutyl)piperidine;methyl 3-methylbutanoate;3-methyl-1-(4-methylpiperazin-1-yl)butan-1-one;3-methyl-1-(6-methyl-3-pyridinyl)butan-1-one;4-methylpentylbenzene;3-(4-methylpentyl)pyridine;1-(4-methylpentyl)-4-(trifluoromethyl)benzene;(4-methylphenyl) 3-methylbutanoate;propan-2-yl 3-methylbutanoate?
N-cyclohexyl-N,3-dimethylbutanamide;cyclohexyl 3-methylbutanoate;N,3-dimethyl-N-(3-methylbutyl)butanamide;1,1-dimethyl-3-(3-methylbutyl)cyclopentane;1-fluoro-4-(4-methylpentyl)benzene;3-methylbutyl 3-methylbutanoate;1-(3-methylbutyl)piperazine;1-(3-methylbutyl)piperidine;methyl 3-methylbutanoate;3-methyl-1-(4-methylpiperazin-1-yl)butan-1-one;3-methyl-1-(6-methyl-3-pyridinyl)butan-1-one;4-methylpentylbenzene;3-(4-methylpentyl)pyridine;1-(4-methylpentyl)-4-(trifluoromethyl)benzene;(4-methylphenyl) 3-methylbutanoate;propan-2-yl 3-methylbutanoate has a molecular weight of 2769.30 g/mol, XLogP of 43.37, 54 rotatable bonds, 1 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N,3-dimethylbutanamide;cyclohexyl 3-methylbutanoate;N,3-dimethyl-N-(3-methylbutyl)butanamide;1,1-dimethyl-3-(3-methylbutyl)cyclopentane;1-fluoro-4-(4-methylpentyl)benzene;3-methylbutyl 3-methylbutanoate;1-(3-methylbutyl)piperazine;1-(3-methylbutyl)piperidine;methyl 3-methylbutanoate;3-methyl-1-(4-methylpiperazin-1-yl)butan-1-one;3-methyl-1-(6-methyl-3-pyridinyl)butan-1-one;4-methylpentylbenzene;3-(4-methylpentyl)pyridine;1-(4-methylpentyl)-4-(trifluoromethyl)benzene;(4-methylphenyl) 3-methylbutanoate;propan-2-yl 3-methylbutanoate is sourced from PubChem (CID 157223997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).