4-amino-N-[1-(3-methoxyphenyl)cyclopentyl]butanamide

C16H24N2O2 — CID 110460844

IUPAC4-amino-N-[1-(3-methoxyphenyl)cyclopentyl]butanamide
SMILESCOc1cccc(C2(NC(=O)CCCN)CCCC2)c1
InChIInChI=1S/C16H24N2O2/c1-20-14-7-4-6-13(12-14)16(9-2-3-10-16)18-15(19)8-5-11-17/h4,6-7,12H,2-3,5,8-11,17H2,1H3,(H,18,19)
InChIKeyHBGAFZNGIWLCCB-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.32
Rot. Bonds6

About 4-amino-N-[1-(3-methoxyphenyl)cyclopentyl]butanamide

4-amino-N-[1-(3-methoxyphenyl)cyclopentyl]butanamide (PubChem CID 110460844) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 4-amino-N-[1-(3-methoxyphenyl)cyclopentyl]butanamide.

Molecular Properties

Compound Name4-amino-N-[1-(3-methoxyphenyl)cyclopentyl]butanamide
PubChem CID110460844
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name4-amino-N-[1-(3-methoxyphenyl)cyclopentyl]butanamide
SMILESCOc1cccc(C2(NC(=O)CCCN)CCCC2)c1
InChIInChI=1S/C16H24N2O2/c1-20-14-7-4-6-13(12-14)16(9-2-3-10-16)18-15(19)8-5-11-17/h4,6-7,12H,2-3,5,8-11,17H2,1H3,(H,18,19)
InChIKeyHBGAFZNGIWLCCB-UHFFFAOYSA-N
XLogP2.32
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-N-[1-(4-methoxyphenyl)cyclopentyl]butanamide
CID 119309997
3-amino-N-[1-(4-methoxyphenyl)cyclohexyl]propanamide
CID 110478988
7-amino-N-[1-(3-chlorophenyl)cyclopentyl]heptanamide;hydrochloride
CID 119815402
N-[1-(3-methoxyphenyl)cyclopentyl]-2-(4-methyl-1,2,5-oxadiazol-3-yl)acetamide
CID 16674747
4-amino-N-[1-(4-chlorophenyl)cyclopentyl]butanamide
CID 119313669
7-amino-N-[1-(3-bromophenyl)cyclobutyl]heptanamide;hydrochloride
CID 119744837
N-[1-(3-methoxyphenyl)cyclopentyl]-3-(2-oxo-1,3-benzoxazol-3-yl)propanamide
CID 16674480
3-[[1-(3-methoxyphenyl)cyclohexyl]amino]-2-methyl-3-oxopropanoic acid
CID 154870795
N-[1-(3-methoxyphenyl)cyclopentyl]-2-(3-oxo-1H-isoindol-2-yl)acetamide
CID 16674649
N-(2-aminoethyl)-1-(3-methoxyphenyl)cyclopentane-1-carboxamide
CID 119383272
N-ethyl-1-(3-methoxyphenyl)cyclohexan-1-amine
CID 57461569
3-(3,5-dimethoxyphenyl)-N-(1-phenylcyclobutyl)propanamide
CID 51273236

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[1-(3-methoxyphenyl)cyclopentyl]butanamide?
The IUPAC name of 4-amino-N-[1-(3-methoxyphenyl)cyclopentyl]butanamide (CID 110460844) is 4-amino-N-[1-(3-methoxyphenyl)cyclopentyl]butanamide.
What is the SMILES notation for 4-amino-N-[1-(3-methoxyphenyl)cyclopentyl]butanamide?
The canonical SMILES for 4-amino-N-[1-(3-methoxyphenyl)cyclopentyl]butanamide is COc1cccc(C2(NC(=O)CCCN)CCCC2)c1.
What is the InChIKey of 4-amino-N-[1-(3-methoxyphenyl)cyclopentyl]butanamide?
The InChIKey is HBGAFZNGIWLCCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-20-14-7-4-6-13(12-14)16(9-2-3-10-16)18-15(19)8-5-11-17/h4,6-7,12H,2-3,5,8-11,17H2,1H3,(H,18,19).
What are the key properties of 4-amino-N-[1-(3-methoxyphenyl)cyclopentyl]butanamide?
4-amino-N-[1-(3-methoxyphenyl)cyclopentyl]butanamide has a molecular weight of 276.38 g/mol, XLogP of 2.32, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[1-(3-methoxyphenyl)cyclopentyl]butanamide is sourced from PubChem (CID 110460844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).