3-amino-N-[(2-cyclopentyloxyphenyl)methyl]propanamide

C15H22N2O2 — CID 119284468

IUPAC3-amino-N-[(2-cyclopentyloxyphenyl)methyl]propanamide
SMILESNCCC(=O)NCc1ccccc1OC1CCCC1
InChIInChI=1S/C15H22N2O2/c16-10-9-15(18)17-11-12-5-1-4-8-14(12)19-13-6-2-3-7-13/h1,4-5,8,13H,2-3,6-7,9-11,16H2,(H,17,18)
InChIKeyLMRFEBYFCDNWNY-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.97
Rot. Bonds6

About 3-amino-N-[(2-cyclopentyloxyphenyl)methyl]propanamide

3-amino-N-[(2-cyclopentyloxyphenyl)methyl]propanamide (PubChem CID 119284468) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 3-amino-N-[(2-cyclopentyloxyphenyl)methyl]propanamide.

Molecular Properties

Compound Name3-amino-N-[(2-cyclopentyloxyphenyl)methyl]propanamide
PubChem CID119284468
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name3-amino-N-[(2-cyclopentyloxyphenyl)methyl]propanamide
SMILESNCCC(=O)NCc1ccccc1OC1CCCC1
InChIInChI=1S/C15H22N2O2/c16-10-9-15(18)17-11-12-5-1-4-8-14(12)19-13-6-2-3-7-13/h1,4-5,8,13H,2-3,6-7,9-11,16H2,(H,17,18)
InChIKeyLMRFEBYFCDNWNY-UHFFFAOYSA-N
XLogP1.97
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-[(2-cyclopentyloxyphenyl)methyl]acetamide
CID 119284470
N-[(2-cyclobutyloxyphenyl)methyl]-2-(methylamino)acetamide
CID 119796176
(2R)-2-amino-N-[(2-cyclobutyloxyphenyl)methyl]propanamide
CID 119330644
2-amino-N-[(2-cyclopentyloxyphenyl)methyl]-2-phenylpropanamide;hydrochloride
CID 120588362
3-amino-N-[(4-cyclohexyloxyphenyl)methyl]propanamide
CID 119312788
N-[(2-cyclopentyloxyphenyl)methyl]-2-methyl-3-(methylamino)propanamide
CID 119714426
4-(aminomethyl)-N-[(2-cyclobutyloxyphenyl)methyl]oxane-4-carboxamide;hydrochloride
CID 120934185
3-amino-N-[(2-ethoxyphenyl)methyl]propanamide
CID 82677450
2-amino-N-[(2-cyclobutyloxyphenyl)methyl]pentanamide
CID 119330646
(2S)-2-amino-N-[(2-cyclobutyloxyphenyl)methyl]-3,3-dimethylbutanamide;hydrochloride
CID 119796181
3-amino-N-[(2-cyclobutyloxyphenyl)methyl]cyclopentane-1-carboxamide
CID 119796168
N-[(2-cyclopentyloxyphenyl)methyl]-2,3-dimethoxybenzamide
CID 55810457

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[(2-cyclopentyloxyphenyl)methyl]propanamide?
The IUPAC name of 3-amino-N-[(2-cyclopentyloxyphenyl)methyl]propanamide (CID 119284468) is 3-amino-N-[(2-cyclopentyloxyphenyl)methyl]propanamide.
What is the SMILES notation for 3-amino-N-[(2-cyclopentyloxyphenyl)methyl]propanamide?
The canonical SMILES for 3-amino-N-[(2-cyclopentyloxyphenyl)methyl]propanamide is NCCC(=O)NCc1ccccc1OC1CCCC1.
What is the InChIKey of 3-amino-N-[(2-cyclopentyloxyphenyl)methyl]propanamide?
The InChIKey is LMRFEBYFCDNWNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c16-10-9-15(18)17-11-12-5-1-4-8-14(12)19-13-6-2-3-7-13/h1,4-5,8,13H,2-3,6-7,9-11,16H2,(H,17,18).
What are the key properties of 3-amino-N-[(2-cyclopentyloxyphenyl)methyl]propanamide?
3-amino-N-[(2-cyclopentyloxyphenyl)methyl]propanamide has a molecular weight of 262.35 g/mol, XLogP of 1.97, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[(2-cyclopentyloxyphenyl)methyl]propanamide is sourced from PubChem (CID 119284468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).