1-amino-N-(2,2-dimethyl-1-phenylpropyl)cyclopentane-1-carboxamide

C17H26N2O — CID 60852989

IUPAC1-amino-N-(2,2-dimethyl-1-phenylpropyl)cyclopentane-1-carboxamide
SMILESCC(C)(C)C(NC(=O)C1(N)CCCC1)c1ccccc1
InChIInChI=1S/C17H26N2O/c1-16(2,3)14(13-9-5-4-6-10-13)19-15(20)17(18)11-7-8-12-17/h4-6,9-10,14H,7-8,11-12,18H2,1-3H3,(H,19,20)
InChIKeyNKAVXDKZEQEYGU-UHFFFAOYSA-N
MW274.41 g/mol
LogP3.16
Rot. Bonds3

About 1-amino-N-(2,2-dimethyl-1-phenylpropyl)cyclopentane-1-carboxamide

1-amino-N-(2,2-dimethyl-1-phenylpropyl)cyclopentane-1-carboxamide (PubChem CID 60852989) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is 1-amino-N-(2,2-dimethyl-1-phenylpropyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-(2,2-dimethyl-1-phenylpropyl)cyclopentane-1-carboxamide
PubChem CID60852989
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC Name1-amino-N-(2,2-dimethyl-1-phenylpropyl)cyclopentane-1-carboxamide
SMILESCC(C)(C)C(NC(=O)C1(N)CCCC1)c1ccccc1
InChIInChI=1S/C17H26N2O/c1-16(2,3)14(13-9-5-4-6-10-13)19-15(20)17(18)11-7-8-12-17/h4-6,9-10,14H,7-8,11-12,18H2,1-3H3,(H,19,20)
InChIKeyNKAVXDKZEQEYGU-UHFFFAOYSA-N
XLogP3.16
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 53.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-amino-N-[1-(4-fluorophenyl)-2,2-dimethylpropyl]cyclopentane-1-carboxamide
CID 60852822
1-amino-N-benzhydrylcyclopentane-1-carboxamide
CID 97030389
1-amino-N-[(1S)-1-phenylethyl]cyclobutane-1-carboxamide
CID 81169221
1-amino-N-(1-phenylethyl)cyclopropane-1-carboxamide
CID 65465678
1-amino-N-[(1R)-2-hydroxy-1-phenylethyl]cyclobutane-1-carboxamide
CID 114010313
1-amino-N-(4-phenylbutan-2-yl)cyclopentane-1-carboxamide
CID 61251912
1-amino-N-(2-hydroxy-2-phenylethyl)cyclohexane-1-carboxamide
CID 43500059
1-amino-N-[2-(dimethylamino)-2-phenylethyl]cyclohexane-1-carboxamide
CID 61250903
1-amino-3-methyl-N-(2-methyl-1-phenylpropyl)cyclohexane-1-carboxamide
CID 64551081
1-amino-N-(2,2-dimethyl-3-phenylpropyl)cyclopentane-1-carboxamide
CID 119329656
(2R)-2-[(1-aminocyclopentanecarbonyl)amino]-3-phenylpropanoic acid
CID 103869046
4-amino-N-[(1R)-1-phenylethyl]oxane-4-carboxamide
CID 113280798

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-(2,2-dimethyl-1-phenylpropyl)cyclopentane-1-carboxamide?
The IUPAC name of 1-amino-N-(2,2-dimethyl-1-phenylpropyl)cyclopentane-1-carboxamide (CID 60852989) is 1-amino-N-(2,2-dimethyl-1-phenylpropyl)cyclopentane-1-carboxamide.
What is the SMILES notation for 1-amino-N-(2,2-dimethyl-1-phenylpropyl)cyclopentane-1-carboxamide?
The canonical SMILES for 1-amino-N-(2,2-dimethyl-1-phenylpropyl)cyclopentane-1-carboxamide is CC(C)(C)C(NC(=O)C1(N)CCCC1)c1ccccc1.
What is the InChIKey of 1-amino-N-(2,2-dimethyl-1-phenylpropyl)cyclopentane-1-carboxamide?
The InChIKey is NKAVXDKZEQEYGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-16(2,3)14(13-9-5-4-6-10-13)19-15(20)17(18)11-7-8-12-17/h4-6,9-10,14H,7-8,11-12,18H2,1-3H3,(H,19,20).
What are the key properties of 1-amino-N-(2,2-dimethyl-1-phenylpropyl)cyclopentane-1-carboxamide?
1-amino-N-(2,2-dimethyl-1-phenylpropyl)cyclopentane-1-carboxamide has a molecular weight of 274.41 g/mol, XLogP of 3.16, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-(2,2-dimethyl-1-phenylpropyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 60852989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).