3-(3-amino-4-methoxyphenyl)-N-cyclopentylpropanamide

C15H22N2O2 — CID 39362398

IUPAC3-(3-amino-4-methoxyphenyl)-N-cyclopentylpropanamide
SMILESCOc1ccc(CCC(=O)NC2CCCC2)cc1N
InChIInChI=1S/C15H22N2O2/c1-19-14-8-6-11(10-13(14)16)7-9-15(18)17-12-4-2-3-5-12/h6,8,10,12H,2-5,7,9,16H2,1H3,(H,17,18)
InChIKeyBVKCHDARNFAENL-UHFFFAOYSA-N
MW262.35 g/mol
LogP2.27
Rot. Bonds5

About 3-(3-amino-4-methoxyphenyl)-N-cyclopentylpropanamide

3-(3-amino-4-methoxyphenyl)-N-cyclopentylpropanamide (PubChem CID 39362398) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 3-(3-amino-4-methoxyphenyl)-N-cyclopentylpropanamide.

Molecular Properties

Compound Name3-(3-amino-4-methoxyphenyl)-N-cyclopentylpropanamide
PubChem CID39362398
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name3-(3-amino-4-methoxyphenyl)-N-cyclopentylpropanamide
SMILESCOc1ccc(CCC(=O)NC2CCCC2)cc1N
InChIInChI=1S/C15H22N2O2/c1-19-14-8-6-11(10-13(14)16)7-9-15(18)17-12-4-2-3-5-12/h6,8,10,12H,2-5,7,9,16H2,1H3,(H,17,18)
InChIKeyBVKCHDARNFAENL-UHFFFAOYSA-N
XLogP2.27
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 ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-cyclododecyl-3-(4-ethoxy-3-methoxyphenyl)propanamide
CID 19221706
N-cyclopentyl-4-(3,4-dimethoxyphenyl)butanamide
CID 110407029
N-(4-aminocyclohexyl)-3-(3,4-dimethoxyphenyl)propanamide
CID 119478687
N-cycloheptyl-3-(3,4-diethoxyphenyl)propanamide
CID 99949717
3-(3-amino-4-methoxyphenyl)-N-ethylpropanamide
CID 39245446
N-cycloheptyl-2-(3,4-dimethoxyphenyl)acetamide
CID 720355
3-(3-bromo-4-methoxyphenyl)-N-(4-methylcyclohexyl)propanamide
CID 46567913
N-(1-acetylpiperidin-4-yl)-3-(3,4-dimethoxyphenyl)propanamide
CID 51203874
N-cyclopropyl-4-(3,4-dimethoxyphenyl)butanamide
CID 110406403
3-[3-amino-4-[(2-fluorophenyl)methoxy]phenyl]-N-cyclopropylpropanamide
CID 82152825
3-(3-amino-4-methoxyphenyl)-1-(2-methylpiperidin-1-yl)propan-1-one
CID 82071342
3-[[amino-[2-(3,4-dimethoxyphenyl)ethylamino]methylidene]amino]-N-cyclohexylpropanamide
CID 111075449

Frequently Asked Questions

What is the IUPAC name of 3-(3-amino-4-methoxyphenyl)-N-cyclopentylpropanamide?
The IUPAC name of 3-(3-amino-4-methoxyphenyl)-N-cyclopentylpropanamide (CID 39362398) is 3-(3-amino-4-methoxyphenyl)-N-cyclopentylpropanamide.
What is the SMILES notation for 3-(3-amino-4-methoxyphenyl)-N-cyclopentylpropanamide?
The canonical SMILES for 3-(3-amino-4-methoxyphenyl)-N-cyclopentylpropanamide is COc1ccc(CCC(=O)NC2CCCC2)cc1N.
What is the InChIKey of 3-(3-amino-4-methoxyphenyl)-N-cyclopentylpropanamide?
The InChIKey is BVKCHDARNFAENL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-19-14-8-6-11(10-13(14)16)7-9-15(18)17-12-4-2-3-5-12/h6,8,10,12H,2-5,7,9,16H2,1H3,(H,17,18).
What are the key properties of 3-(3-amino-4-methoxyphenyl)-N-cyclopentylpropanamide?
3-(3-amino-4-methoxyphenyl)-N-cyclopentylpropanamide has a molecular weight of 262.35 g/mol, XLogP of 2.27, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-amino-4-methoxyphenyl)-N-cyclopentylpropanamide is sourced from PubChem (CID 39362398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).