1-[2-(3-methoxyphenyl)ethylcarbamoylamino]cyclopentane-1-carboxamide

C16H23N3O3 — CID 119074312

IUPAC1-[2-(3-methoxyphenyl)ethylcarbamoylamino]cyclopentane-1-carboxamide
SMILESCOc1cccc(CCNC(=O)NC2(C(N)=O)CCCC2)c1
InChIInChI=1S/C16H23N3O3/c1-22-13-6-4-5-12(11-13)7-10-18-15(21)19-16(14(17)20)8-2-3-9-16/h4-6,11H,2-3,7-10H2,1H3,(H2,17,20)(H2,18,19,21)
InChIKeyHYIKRDGMHZQYCN-UHFFFAOYSA-N
MW305.38 g/mol
LogP1.34
Rot. Bonds6

About 1-[2-(3-methoxyphenyl)ethylcarbamoylamino]cyclopentane-1-carboxamide

1-[2-(3-methoxyphenyl)ethylcarbamoylamino]cyclopentane-1-carboxamide (PubChem CID 119074312) has the molecular formula C16H23N3O3 and a molecular weight of 305.38 g/mol. Its IUPAC name is 1-[2-(3-methoxyphenyl)ethylcarbamoylamino]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-[2-(3-methoxyphenyl)ethylcarbamoylamino]cyclopentane-1-carboxamide
PubChem CID119074312
Molecular FormulaC16H23N3O3
Molecular Weight305.38 g/mol
Exact Mass305.17
IUPAC Name1-[2-(3-methoxyphenyl)ethylcarbamoylamino]cyclopentane-1-carboxamide
SMILESCOc1cccc(CCNC(=O)NC2(C(N)=O)CCCC2)c1
InChIInChI=1S/C16H23N3O3/c1-22-13-6-4-5-12(11-13)7-10-18-15(21)19-16(14(17)20)8-2-3-9-16/h4-6,11H,2-3,7-10H2,1H3,(H2,17,20)(H2,18,19,21)
InChIKeyHYIKRDGMHZQYCN-UHFFFAOYSA-N
XLogP1.34
TPSA93.45 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 51.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 1-[2-(3-methoxyphenyl)ethylcarbamoylamino]cyclopentane-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-amino-N-[2-(3-methoxyphenyl)ethyl]cyclopropane-1-carboxamide;hydrochloride
CID 119711038
2-(1-aminocyclobutyl)-N-[2-(3-methoxyphenyl)ethyl]acetamide
CID 103808810
1-[2-(3-methoxyphenyl)ethyl]-3-[(1-phenylcyclopropyl)methyl]urea
CID 113213849
1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[(3-methoxyphenyl)methyl]urea
CID 108891449
1-(hydroxymethyl)-N-[2-(3-methoxyphenyl)ethyl]cyclobutane-1-carboxamide
CID 115184171
methyl 3-[2-(3-methoxyphenyl)ethylcarbamoylamino]propanoate
CID 108901083
2-amino-N-[2-(3-methoxyphenyl)ethyl]acetamide
CID 22690352
1-[2-(3-hydroxyphenyl)ethyl]-3-[(3-methoxyphenyl)methyl]urea
CID 60602886
1-amino-N-[3-(3-methoxyphenyl)propyl]cyclohexane-1-carboxamide
CID 119316887
1-amino-N-[3-(3-methoxyphenyl)propyl]cyclopentane-1-carboxamide;hydrochloride
CID 119316878
N-[2-(3-methoxyphenyl)ethyl]-2-oxopropanamide
CID 110478240
1-[2-(4-methoxyphenyl)ethyl]-3-[(3-methoxyphenyl)methyl]urea
CID 51290894

Frequently Asked Questions

What is the IUPAC name of 1-[2-(3-methoxyphenyl)ethylcarbamoylamino]cyclopentane-1-carboxamide?
The IUPAC name of 1-[2-(3-methoxyphenyl)ethylcarbamoylamino]cyclopentane-1-carboxamide (CID 119074312) is 1-[2-(3-methoxyphenyl)ethylcarbamoylamino]cyclopentane-1-carboxamide.
What is the SMILES notation for 1-[2-(3-methoxyphenyl)ethylcarbamoylamino]cyclopentane-1-carboxamide?
The canonical SMILES for 1-[2-(3-methoxyphenyl)ethylcarbamoylamino]cyclopentane-1-carboxamide is COc1cccc(CCNC(=O)NC2(C(N)=O)CCCC2)c1.
What is the InChIKey of 1-[2-(3-methoxyphenyl)ethylcarbamoylamino]cyclopentane-1-carboxamide?
The InChIKey is HYIKRDGMHZQYCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O3/c1-22-13-6-4-5-12(11-13)7-10-18-15(21)19-16(14(17)20)8-2-3-9-16/h4-6,11H,2-3,7-10H2,1H3,(H2,17,20)(H2,18,19,21).
What are the key properties of 1-[2-(3-methoxyphenyl)ethylcarbamoylamino]cyclopentane-1-carboxamide?
1-[2-(3-methoxyphenyl)ethylcarbamoylamino]cyclopentane-1-carboxamide has a molecular weight of 305.38 g/mol, XLogP of 1.34, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(3-methoxyphenyl)ethylcarbamoylamino]cyclopentane-1-carboxamide is sourced from PubChem (CID 119074312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).