N-[1-(aminomethyl)cyclopentyl]-2-(3,4-dimethylphenoxy)acetamide

C16H24N2O2 — CID 119565775

IUPACN-[1-(aminomethyl)cyclopentyl]-2-(3,4-dimethylphenoxy)acetamide
SMILESCc1ccc(OCC(=O)NC2(CN)CCCC2)cc1C
InChIInChI=1S/C16H24N2O2/c1-12-5-6-14(9-13(12)2)20-10-15(19)18-16(11-17)7-3-4-8-16/h5-6,9H,3-4,7-8,10-11,17H2,1-2H3,(H,18,19)
InChIKeyALZNGXGUAIULAB-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.07
Rot. Bonds5

About N-[1-(aminomethyl)cyclopentyl]-2-(3,4-dimethylphenoxy)acetamide

N-[1-(aminomethyl)cyclopentyl]-2-(3,4-dimethylphenoxy)acetamide (PubChem CID 119565775) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N-[1-(aminomethyl)cyclopentyl]-2-(3,4-dimethylphenoxy)acetamide.

Molecular Properties

Compound NameN-[1-(aminomethyl)cyclopentyl]-2-(3,4-dimethylphenoxy)acetamide
PubChem CID119565775
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC NameN-[1-(aminomethyl)cyclopentyl]-2-(3,4-dimethylphenoxy)acetamide
SMILESCc1ccc(OCC(=O)NC2(CN)CCCC2)cc1C
InChIInChI=1S/C16H24N2O2/c1-12-5-6-14(9-13(12)2)20-10-15(19)18-16(11-17)7-3-4-8-16/h5-6,9H,3-4,7-8,10-11,17H2,1-2H3,(H,18,19)
InChIKeyALZNGXGUAIULAB-UHFFFAOYSA-N
XLogP2.07
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(aminomethyl)cyclopentyl]-2-(4-iodophenoxy)acetamide;hydrochloride
CID 119567396
N-[1-(aminomethyl)cyclopentyl]-2-(3-methylphenoxy)acetamide;hydrochloride
CID 119567192
N-[1-(aminomethyl)cyclopentyl]-2-(2,4,6-trimethylphenoxy)acetamide
CID 119567203
N-[1-(aminomethyl)cyclohexyl]-2-phenoxyacetamide
CID 63755837
N-[1-(aminomethyl)cyclopentyl]-2-(3-fluoro-4-nitrophenoxy)acetamide
CID 119567004
N-[1-(aminomethyl)cyclopentyl]-3-(3,4-dimethylphenyl)sulfanylpropanamide
CID 119567373
2-[1-[[2-(4-chloro-3-methylphenoxy)acetyl]amino]cyclobutyl]acetic acid
CID 79844652
N-[1-(aminomethyl)cyclohexyl]-2-methoxyacetamide
CID 63755662
N-[(2S)-1-aminopropan-2-yl]-2-(3,4-dimethylphenoxy)acetamide;hydrochloride
CID 120507366
methyl 2-[[2-(3,4-dimethylphenoxy)acetyl]amino]-3-hydroxypropanoate
CID 43405748
2-(3,4-dimethylphenoxy)-N-[8-[[2-(3,4-dimethylphenoxy)acetyl]amino]octyl]acetamide
CID 17233359
N-[1-(aminomethyl)cyclopentyl]-2-(4-ethoxyphenyl)acetamide;hydrochloride
CID 119564832

Frequently Asked Questions

What is the IUPAC name of N-[1-(aminomethyl)cyclopentyl]-2-(3,4-dimethylphenoxy)acetamide?
The IUPAC name of N-[1-(aminomethyl)cyclopentyl]-2-(3,4-dimethylphenoxy)acetamide (CID 119565775) is N-[1-(aminomethyl)cyclopentyl]-2-(3,4-dimethylphenoxy)acetamide.
What is the SMILES notation for N-[1-(aminomethyl)cyclopentyl]-2-(3,4-dimethylphenoxy)acetamide?
The canonical SMILES for N-[1-(aminomethyl)cyclopentyl]-2-(3,4-dimethylphenoxy)acetamide is Cc1ccc(OCC(=O)NC2(CN)CCCC2)cc1C.
What is the InChIKey of N-[1-(aminomethyl)cyclopentyl]-2-(3,4-dimethylphenoxy)acetamide?
The InChIKey is ALZNGXGUAIULAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-12-5-6-14(9-13(12)2)20-10-15(19)18-16(11-17)7-3-4-8-16/h5-6,9H,3-4,7-8,10-11,17H2,1-2H3,(H,18,19).
What are the key properties of N-[1-(aminomethyl)cyclopentyl]-2-(3,4-dimethylphenoxy)acetamide?
N-[1-(aminomethyl)cyclopentyl]-2-(3,4-dimethylphenoxy)acetamide has a molecular weight of 276.38 g/mol, XLogP of 2.07, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(aminomethyl)cyclopentyl]-2-(3,4-dimethylphenoxy)acetamide is sourced from PubChem (CID 119565775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).