3-amino-N-(3-cyclohexylbutan-2-yl)cyclopentane-1-carboxamide;hydrochloride

C16H31ClN2O — CID 119809032

IUPAC3-amino-N-(3-cyclohexylbutan-2-yl)cyclopentane-1-carboxamide;hydrochloride
SMILESCC(NC(=O)C1CCC(N)C1)C(C)C1CCCCC1.Cl
InChIInChI=1S/C16H30N2O.ClH/c1-11(13-6-4-3-5-7-13)12(2)18-16(19)14-8-9-15(17)10-14;/h11-15H,3-10,17H2,1-2H3,(H,18,19);1H
InChIKeyKPAQGLMDZPWELO-UHFFFAOYSA-N
MW302.89 g/mol
LogP3.26
Rot. Bonds4

About 3-amino-N-(3-cyclohexylbutan-2-yl)cyclopentane-1-carboxamide;hydrochloride

3-amino-N-(3-cyclohexylbutan-2-yl)cyclopentane-1-carboxamide;hydrochloride (PubChem CID 119809032) has the molecular formula C16H31ClN2O and a molecular weight of 302.89 g/mol. Its IUPAC name is 3-amino-N-(3-cyclohexylbutan-2-yl)cyclopentane-1-carboxamide;hydrochloride.

Molecular Properties

Compound Name3-amino-N-(3-cyclohexylbutan-2-yl)cyclopentane-1-carboxamide;hydrochloride
PubChem CID119809032
Molecular FormulaC16H31ClN2O
Molecular Weight302.89 g/mol
Exact Mass302.21
IUPAC Name3-amino-N-(3-cyclohexylbutan-2-yl)cyclopentane-1-carboxamide;hydrochloride
SMILESCC(NC(=O)C1CCC(N)C1)C(C)C1CCCCC1.Cl
InChIInChI=1S/C16H30N2O.ClH/c1-11(13-6-4-3-5-7-13)12(2)18-16(19)14-8-9-15(17)10-14;/h11-15H,3-10,17H2,1-2H3,(H,18,19);1H
InChIKeyKPAQGLMDZPWELO-UHFFFAOYSA-N
XLogP3.26
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.89
LogP ≤ 53.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-N-(3-cyclohexylbutan-2-yl)cyclopentane-1-carboxamide
CID 119809033
3-amino-N-(1-cyclopentylethyl)cyclopentane-1-carboxamide;hydrochloride
CID 119782445
3-amino-N-(1-cyclohexylpropyl)cyclohexane-1-carboxamide
CID 62776840
3-amino-N-[(2S)-1-amino-1-oxopropan-2-yl]cyclopentane-1-carboxamide
CID 130163371
3-amino-N-(1-amino-1-oxopropan-2-yl)cyclopentane-1-carboxamide
CID 66031893
3-amino-N-(4-propan-2-ylcyclohexyl)cyclopentane-1-carboxamide;hydrochloride
CID 119812000
methyl 2-[(3-aminocyclopentanecarbonyl)amino]propanoate;hydrochloride
CID 119726434
N-(3-cyclohexylbutan-2-yl)pyrrolidine-3-carboxamide
CID 119809069
(2R)-2-[(3-aminocyclopentanecarbonyl)amino]-3-methylbutanoic acid
CID 66009453
3-amino-N-(1-amino-3-methyl-1-oxobutan-2-yl)cyclopentane-1-carboxamide
CID 103810507
3-amino-N-(3-cyclohexylbutan-2-yl)-2-methylbutanamide
CID 120501833
(2S,3R)-2-[(3-aminocyclopentanecarbonyl)amino]-3-hydroxybutanoic acid
CID 104965247

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(3-cyclohexylbutan-2-yl)cyclopentane-1-carboxamide;hydrochloride?
The IUPAC name of 3-amino-N-(3-cyclohexylbutan-2-yl)cyclopentane-1-carboxamide;hydrochloride (CID 119809032) is 3-amino-N-(3-cyclohexylbutan-2-yl)cyclopentane-1-carboxamide;hydrochloride.
What is the SMILES notation for 3-amino-N-(3-cyclohexylbutan-2-yl)cyclopentane-1-carboxamide;hydrochloride?
The canonical SMILES for 3-amino-N-(3-cyclohexylbutan-2-yl)cyclopentane-1-carboxamide;hydrochloride is CC(NC(=O)C1CCC(N)C1)C(C)C1CCCCC1.Cl.
What is the InChIKey of 3-amino-N-(3-cyclohexylbutan-2-yl)cyclopentane-1-carboxamide;hydrochloride?
The InChIKey is KPAQGLMDZPWELO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O.ClH/c1-11(13-6-4-3-5-7-13)12(2)18-16(19)14-8-9-15(17)10-14;/h11-15H,3-10,17H2,1-2H3,(H,18,19);1H.
What are the key properties of 3-amino-N-(3-cyclohexylbutan-2-yl)cyclopentane-1-carboxamide;hydrochloride?
3-amino-N-(3-cyclohexylbutan-2-yl)cyclopentane-1-carboxamide;hydrochloride has a molecular weight of 302.89 g/mol, XLogP of 3.26, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(3-cyclohexylbutan-2-yl)cyclopentane-1-carboxamide;hydrochloride is sourced from PubChem (CID 119809032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).