N-(1-aminohexan-2-yl)-1-(3-methoxyphenyl)cyclopentane-1-carboxamide

C19H30N2O2 — CID 119666253

IUPACN-(1-aminohexan-2-yl)-1-(3-methoxyphenyl)cyclopentane-1-carboxamide
SMILESCCCCC(CN)NC(=O)C1(c2cccc(OC)c2)CCCC1
InChIInChI=1S/C19H30N2O2/c1-3-4-9-16(14-20)21-18(22)19(11-5-6-12-19)15-8-7-10-17(13-15)23-2/h7-8,10,13,16H,3-6,9,11-12,14,20H2,1-2H3,(H,21,22)
InChIKeyNPDSECDBDDPMMZ-UHFFFAOYSA-N
MW318.46 g/mol
LogP3.14
Rot. Bonds8

About N-(1-aminohexan-2-yl)-1-(3-methoxyphenyl)cyclopentane-1-carboxamide

N-(1-aminohexan-2-yl)-1-(3-methoxyphenyl)cyclopentane-1-carboxamide (PubChem CID 119666253) has the molecular formula C19H30N2O2 and a molecular weight of 318.46 g/mol. Its IUPAC name is N-(1-aminohexan-2-yl)-1-(3-methoxyphenyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound NameN-(1-aminohexan-2-yl)-1-(3-methoxyphenyl)cyclopentane-1-carboxamide
PubChem CID119666253
Molecular FormulaC19H30N2O2
Molecular Weight318.46 g/mol
Exact Mass318.23
IUPAC NameN-(1-aminohexan-2-yl)-1-(3-methoxyphenyl)cyclopentane-1-carboxamide
SMILESCCCCC(CN)NC(=O)C1(c2cccc(OC)c2)CCCC1
InChIInChI=1S/C19H30N2O2/c1-3-4-9-16(14-20)21-18(22)19(11-5-6-12-19)15-8-7-10-17(13-15)23-2/h7-8,10,13,16H,3-6,9,11-12,14,20H2,1-2H3,(H,21,22)
InChIKeyNPDSECDBDDPMMZ-UHFFFAOYSA-N
XLogP3.14
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.46
LogP ≤ 53.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-aminohexan-2-yl)-1-(3-fluorophenyl)cyclopentane-1-carboxamide;hydrochloride
CID 119664783
N-(1-aminohexan-2-yl)-1-phenylcyclopentane-1-carboxamide;hydrochloride
CID 119667911
N-(1-aminohexan-2-yl)-1-phenylcyclopropane-1-carboxamide
CID 80698357
N-(2-amino-1-cyclopropylethyl)-1-(3-methoxyphenyl)cyclopentane-1-carboxamide;hydrochloride
CID 119614549
2-[[1-(3-methoxyphenyl)cyclopentanecarbonyl]amino]propanoic acid
CID 119225858
N-(2-aminoethyl)-1-(3-methoxyphenyl)cyclopentane-1-carboxamide
CID 119383272
N-(1-aminohexan-2-yl)-2-(3-methoxyphenyl)acetamide;hydrochloride
CID 119664823
N-(2-amino-2-methylpropyl)-1-(3-methoxyphenyl)cyclopentane-1-carboxamide
CID 119627481
N-(1-aminohexan-2-yl)-2-(3-methoxyphenyl)propanamide;hydrochloride
CID 119665599
N-(1-aminohexan-2-yl)-3-(3-methoxyphenyl)propanamide;hydrochloride
CID 119668074
3-[[1-(3-methoxyphenyl)cyclopentanecarbonyl]amino]-2-phenylpropanoic acid
CID 119255048
N-[2-(aminomethyl)cyclopentyl]-1-(3-methoxyphenyl)cyclopentane-1-carboxamide
CID 119602262

Frequently Asked Questions

What is the IUPAC name of N-(1-aminohexan-2-yl)-1-(3-methoxyphenyl)cyclopentane-1-carboxamide?
The IUPAC name of N-(1-aminohexan-2-yl)-1-(3-methoxyphenyl)cyclopentane-1-carboxamide (CID 119666253) is N-(1-aminohexan-2-yl)-1-(3-methoxyphenyl)cyclopentane-1-carboxamide.
What is the SMILES notation for N-(1-aminohexan-2-yl)-1-(3-methoxyphenyl)cyclopentane-1-carboxamide?
The canonical SMILES for N-(1-aminohexan-2-yl)-1-(3-methoxyphenyl)cyclopentane-1-carboxamide is CCCCC(CN)NC(=O)C1(c2cccc(OC)c2)CCCC1.
What is the InChIKey of N-(1-aminohexan-2-yl)-1-(3-methoxyphenyl)cyclopentane-1-carboxamide?
The InChIKey is NPDSECDBDDPMMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N2O2/c1-3-4-9-16(14-20)21-18(22)19(11-5-6-12-19)15-8-7-10-17(13-15)23-2/h7-8,10,13,16H,3-6,9,11-12,14,20H2,1-2H3,(H,21,22).
What are the key properties of N-(1-aminohexan-2-yl)-1-(3-methoxyphenyl)cyclopentane-1-carboxamide?
N-(1-aminohexan-2-yl)-1-(3-methoxyphenyl)cyclopentane-1-carboxamide has a molecular weight of 318.46 g/mol, XLogP of 3.14, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-aminohexan-2-yl)-1-(3-methoxyphenyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 119666253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).