N-(1-aminohexan-2-yl)-1-phenylcyclopentane-1-carboxamide;hydrochloride

C18H29ClN2O — CID 119667911

IUPACN-(1-aminohexan-2-yl)-1-phenylcyclopentane-1-carboxamide;hydrochloride
SMILESCCCCC(CN)NC(=O)C1(c2ccccc2)CCCC1.Cl
InChIInChI=1S/C18H28N2O.ClH/c1-2-3-11-16(14-19)20-17(21)18(12-7-8-13-18)15-9-5-4-6-10-15;/h4-6,9-10,16H,2-3,7-8,11-14,19H2,1H3,(H,20,21);1H
InChIKeyJTOGHTAUSVZQNY-UHFFFAOYSA-N
MW324.90 g/mol
LogP3.55
Rot. Bonds7

About N-(1-aminohexan-2-yl)-1-phenylcyclopentane-1-carboxamide;hydrochloride

N-(1-aminohexan-2-yl)-1-phenylcyclopentane-1-carboxamide;hydrochloride (PubChem CID 119667911) has the molecular formula C18H29ClN2O and a molecular weight of 324.90 g/mol. Its IUPAC name is N-(1-aminohexan-2-yl)-1-phenylcyclopentane-1-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(1-aminohexan-2-yl)-1-phenylcyclopentane-1-carboxamide;hydrochloride
PubChem CID119667911
Molecular FormulaC18H29ClN2O
Molecular Weight324.90 g/mol
Exact Mass324.20
IUPAC NameN-(1-aminohexan-2-yl)-1-phenylcyclopentane-1-carboxamide;hydrochloride
SMILESCCCCC(CN)NC(=O)C1(c2ccccc2)CCCC1.Cl
InChIInChI=1S/C18H28N2O.ClH/c1-2-3-11-16(14-19)20-17(21)18(12-7-8-13-18)15-9-5-4-6-10-15;/h4-6,9-10,16H,2-3,7-8,11-14,19H2,1H3,(H,20,21);1H
InChIKeyJTOGHTAUSVZQNY-UHFFFAOYSA-N
XLogP3.55
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.90
LogP ≤ 53.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-aminohexan-2-yl)-1-phenylcyclopropane-1-carboxamide
CID 80698357
N-(1-aminohexan-2-yl)-1-(3-fluorophenyl)cyclopentane-1-carboxamide;hydrochloride
CID 119664783
N-(1-aminohexan-2-yl)-1-(3-methoxyphenyl)cyclopentane-1-carboxamide
CID 119666253
(2S)-2-[(1-phenylcyclobutanecarbonyl)amino]hexanoic acid
CID 107144402
N-[(2S)-1-aminopropan-2-yl]-1-phenylcyclopentane-1-carboxamide
CID 120505049
N-(1-aminohexan-2-yl)-1-benzylcyclopropane-1-carboxamide
CID 119667821
2-[(1-phenylcyclobutanecarbonyl)amino]pentanoic acid
CID 43630836
N-(2-amino-1-cyclopropylethyl)-1-phenylcyclopentane-1-carboxamide
CID 119616687
1-acetamido-N-(1-aminohexan-2-yl)cyclohexane-1-carboxamide;hydrochloride
CID 119665001
1-phenyl-N-[(2S)-4-phenylbutan-2-yl]cyclopentane-1-carboxamide
CID 1220424
N-ethyl-1-phenylcyclopentane-1-carboxamide
CID 778764
1-acetamido-N-(1-aminohexan-2-yl)cyclohexane-1-carboxamide
CID 119665002

Frequently Asked Questions

What is the IUPAC name of N-(1-aminohexan-2-yl)-1-phenylcyclopentane-1-carboxamide;hydrochloride?
The IUPAC name of N-(1-aminohexan-2-yl)-1-phenylcyclopentane-1-carboxamide;hydrochloride (CID 119667911) is N-(1-aminohexan-2-yl)-1-phenylcyclopentane-1-carboxamide;hydrochloride.
What is the SMILES notation for N-(1-aminohexan-2-yl)-1-phenylcyclopentane-1-carboxamide;hydrochloride?
The canonical SMILES for N-(1-aminohexan-2-yl)-1-phenylcyclopentane-1-carboxamide;hydrochloride is CCCCC(CN)NC(=O)C1(c2ccccc2)CCCC1.Cl.
What is the InChIKey of N-(1-aminohexan-2-yl)-1-phenylcyclopentane-1-carboxamide;hydrochloride?
The InChIKey is JTOGHTAUSVZQNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O.ClH/c1-2-3-11-16(14-19)20-17(21)18(12-7-8-13-18)15-9-5-4-6-10-15;/h4-6,9-10,16H,2-3,7-8,11-14,19H2,1H3,(H,20,21);1H.
What are the key properties of N-(1-aminohexan-2-yl)-1-phenylcyclopentane-1-carboxamide;hydrochloride?
N-(1-aminohexan-2-yl)-1-phenylcyclopentane-1-carboxamide;hydrochloride has a molecular weight of 324.90 g/mol, XLogP of 3.55, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-aminohexan-2-yl)-1-phenylcyclopentane-1-carboxamide;hydrochloride is sourced from PubChem (CID 119667911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).