N-[2-(aminomethyl)cyclopentyl]-2-(3-methylphenoxy)acetamide

C15H22N2O2 — CID 119603622

IUPACN-[2-(aminomethyl)cyclopentyl]-2-(3-methylphenoxy)acetamide
SMILESCc1cccc(OCC(=O)NC2CCCC2CN)c1
InChIInChI=1S/C15H22N2O2/c1-11-4-2-6-13(8-11)19-10-15(18)17-14-7-3-5-12(14)9-16/h2,4,6,8,12,14H,3,5,7,9-10,16H2,1H3,(H,17,18)
InChIKeyKSJMFFFQXZOKSV-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.62
Rot. Bonds5

About N-[2-(aminomethyl)cyclopentyl]-2-(3-methylphenoxy)acetamide

N-[2-(aminomethyl)cyclopentyl]-2-(3-methylphenoxy)acetamide (PubChem CID 119603622) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is N-[2-(aminomethyl)cyclopentyl]-2-(3-methylphenoxy)acetamide.

Molecular Properties

Compound NameN-[2-(aminomethyl)cyclopentyl]-2-(3-methylphenoxy)acetamide
PubChem CID119603622
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC NameN-[2-(aminomethyl)cyclopentyl]-2-(3-methylphenoxy)acetamide
SMILESCc1cccc(OCC(=O)NC2CCCC2CN)c1
InChIInChI=1S/C15H22N2O2/c1-11-4-2-6-13(8-11)19-10-15(18)17-14-7-3-5-12(14)9-16/h2,4,6,8,12,14H,3,5,7,9-10,16H2,1H3,(H,17,18)
InChIKeyKSJMFFFQXZOKSV-UHFFFAOYSA-N
XLogP1.62
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(aminomethyl)cyclopentyl]-2-phenoxyacetamide;hydrochloride
CID 119601101
N-[(1S,2S,3R)-2,3-dimethylcyclohexyl]-2-(3-methylphenoxy)acetamide
CID 11920025
N-[2-(aminomethyl)cyclopentyl]-2-(2,6-dimethylphenoxy)acetamide
CID 119605033
N-[2-(aminomethyl)cyclopentyl]-2-(2,4,6-trimethylphenoxy)acetamide;hydrochloride
CID 119603633
N-[(1S,2S)-2-ethylsulfanylcyclopentyl]-2-(3-methylphenoxy)acetamide
CID 95972526
N-[2-(aminomethyl)cyclohexyl]-2-(2,5-dimethylphenoxy)acetamide
CID 119611347
N-[2-(aminomethyl)cyclopentyl]-2-[3-(2-oxopyrrolidin-1-yl)phenoxy]acetamide;hydrochloride
CID 119602651
N-[2-(aminomethyl)cyclopentyl]-2-(4-ethylphenoxy)acetamide
CID 119601137
[2-[[(1S,2S,3S)-2,3-dimethylcyclohexyl]amino]-2-oxoethyl] 2-(3-methylphenoxy)acetate
CID 6597337
[2-[[(1R,2S,3R)-2,3-dimethylcyclohexyl]amino]-2-oxoethyl] 2-(3-methylphenoxy)acetate
CID 11904739
N-[2-(aminomethyl)cyclopentyl]-3-(3-methylphenyl)propanamide
CID 62955686
N-[2-(aminomethyl)cyclohexyl]-2-(4-ethoxyphenoxy)acetamide;hydrochloride
CID 119610949

Frequently Asked Questions

What is the IUPAC name of N-[2-(aminomethyl)cyclopentyl]-2-(3-methylphenoxy)acetamide?
The IUPAC name of N-[2-(aminomethyl)cyclopentyl]-2-(3-methylphenoxy)acetamide (CID 119603622) is N-[2-(aminomethyl)cyclopentyl]-2-(3-methylphenoxy)acetamide.
What is the SMILES notation for N-[2-(aminomethyl)cyclopentyl]-2-(3-methylphenoxy)acetamide?
The canonical SMILES for N-[2-(aminomethyl)cyclopentyl]-2-(3-methylphenoxy)acetamide is Cc1cccc(OCC(=O)NC2CCCC2CN)c1.
What is the InChIKey of N-[2-(aminomethyl)cyclopentyl]-2-(3-methylphenoxy)acetamide?
The InChIKey is KSJMFFFQXZOKSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-11-4-2-6-13(8-11)19-10-15(18)17-14-7-3-5-12(14)9-16/h2,4,6,8,12,14H,3,5,7,9-10,16H2,1H3,(H,17,18).
What are the key properties of N-[2-(aminomethyl)cyclopentyl]-2-(3-methylphenoxy)acetamide?
N-[2-(aminomethyl)cyclopentyl]-2-(3-methylphenoxy)acetamide has a molecular weight of 262.35 g/mol, XLogP of 1.62, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(aminomethyl)cyclopentyl]-2-(3-methylphenoxy)acetamide is sourced from PubChem (CID 119603622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).