1-(aminomethyl)-N-(1-phenylethyl)cyclopentane-1-carboxamide

C15H22N2O — CID 55037856

IUPAC1-(aminomethyl)-N-(1-phenylethyl)cyclopentane-1-carboxamide
SMILESCC(NC(=O)C1(CN)CCCC1)c1ccccc1
InChIInChI=1S/C15H22N2O/c1-12(13-7-3-2-4-8-13)17-14(18)15(11-16)9-5-6-10-15/h2-4,7-8,12H,5-6,9-11,16H2,1H3,(H,17,18)
InChIKeyHDYGWMITMDCBKH-UHFFFAOYSA-N
MW246.35 g/mol
LogP2.38
Rot. Bonds4

About 1-(aminomethyl)-N-(1-phenylethyl)cyclopentane-1-carboxamide

1-(aminomethyl)-N-(1-phenylethyl)cyclopentane-1-carboxamide (PubChem CID 55037856) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is 1-(aminomethyl)-N-(1-phenylethyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-(aminomethyl)-N-(1-phenylethyl)cyclopentane-1-carboxamide
PubChem CID55037856
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC Name1-(aminomethyl)-N-(1-phenylethyl)cyclopentane-1-carboxamide
SMILESCC(NC(=O)C1(CN)CCCC1)c1ccccc1
InChIInChI=1S/C15H22N2O/c1-12(13-7-3-2-4-8-13)17-14(18)15(11-16)9-5-6-10-15/h2-4,7-8,12H,5-6,9-11,16H2,1H3,(H,17,18)
InChIKeyHDYGWMITMDCBKH-UHFFFAOYSA-N
XLogP2.38
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(aminomethyl)-N-(1-phenylethyl)cyclobutane-1-carboxamide
CID 80586699
1-(aminomethyl)-N-[1-(4-chlorophenyl)ethyl]cyclopentane-1-carboxamide;hydrochloride
CID 119685506
1-(aminomethyl)-N-[(1R)-1-pyridin-4-ylethyl]cyclopentane-1-carboxamide
CID 94008169
1-(aminomethyl)-N-[(1R)-1-(3-bromophenyl)ethyl]cycloheptane-1-carboxamide
CID 115444286
1-(aminomethyl)-N-[1-(3-bromophenyl)ethyl]cyclopentane-1-carboxamide;hydrochloride
CID 119716410
1-(aminomethyl)-N-[1-(4-fluorophenyl)ethyl]cyclobutane-1-carboxamide
CID 80588663
1-(aminomethyl)-N-[1-(3-bromophenyl)ethyl]cyclobutane-1-carboxamide
CID 113311577
1-(aminomethyl)-N-[1-(4-methoxyphenyl)ethyl]cyclohexane-1-carboxamide
CID 66197186
1-(aminomethyl)-N-[1-(2-methylphenyl)ethyl]cyclopentane-1-carboxamide
CID 55037857
1-(aminomethyl)-N-[1-[4-(carbamoylamino)phenyl]ethyl]cyclopentane-1-carboxamide;hydrochloride
CID 119721956
1-(aminomethyl)-N-[1-[3-(trifluoromethyl)phenyl]ethyl]cyclopentane-1-carboxamide
CID 119686311
1-(aminomethyl)-N-[1-(4-methylsulfanylphenyl)ethyl]cyclobutane-1-carboxamide
CID 115447604

Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)-N-(1-phenylethyl)cyclopentane-1-carboxamide?
The IUPAC name of 1-(aminomethyl)-N-(1-phenylethyl)cyclopentane-1-carboxamide (CID 55037856) is 1-(aminomethyl)-N-(1-phenylethyl)cyclopentane-1-carboxamide.
What is the SMILES notation for 1-(aminomethyl)-N-(1-phenylethyl)cyclopentane-1-carboxamide?
The canonical SMILES for 1-(aminomethyl)-N-(1-phenylethyl)cyclopentane-1-carboxamide is CC(NC(=O)C1(CN)CCCC1)c1ccccc1.
What is the InChIKey of 1-(aminomethyl)-N-(1-phenylethyl)cyclopentane-1-carboxamide?
The InChIKey is HDYGWMITMDCBKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-12(13-7-3-2-4-8-13)17-14(18)15(11-16)9-5-6-10-15/h2-4,7-8,12H,5-6,9-11,16H2,1H3,(H,17,18).
What are the key properties of 1-(aminomethyl)-N-(1-phenylethyl)cyclopentane-1-carboxamide?
1-(aminomethyl)-N-(1-phenylethyl)cyclopentane-1-carboxamide has a molecular weight of 246.35 g/mol, XLogP of 2.38, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)-N-(1-phenylethyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 55037856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).