N-cyclopentyl-N'-(3-hydroxyphenyl)oxamide

C13H16N2O3 — CID 44995644

IUPACN-cyclopentyl-N'-(3-hydroxyphenyl)oxamide
SMILESO=C(Nc1cccc(O)c1)C(=O)NC1CCCC1
InChIInChI=1S/C13H16N2O3/c16-11-7-3-6-10(8-11)15-13(18)12(17)14-9-4-1-2-5-9/h3,6-9,16H,1-2,4-5H2,(H,14,17)(H,15,18)
InChIKeyTWFZDDNUFMBSHJ-UHFFFAOYSA-N
MW248.28 g/mol
LogP1.39
Rot. Bonds2

About N-cyclopentyl-N'-(3-hydroxyphenyl)oxamide

N-cyclopentyl-N'-(3-hydroxyphenyl)oxamide (PubChem CID 44995644) has the molecular formula C13H16N2O3 and a molecular weight of 248.28 g/mol. Its IUPAC name is N-cyclopentyl-N'-(3-hydroxyphenyl)oxamide.

Molecular Properties

Compound NameN-cyclopentyl-N'-(3-hydroxyphenyl)oxamide
PubChem CID44995644
Molecular FormulaC13H16N2O3
Molecular Weight248.28 g/mol
Exact Mass248.12
IUPAC NameN-cyclopentyl-N'-(3-hydroxyphenyl)oxamide
SMILESO=C(Nc1cccc(O)c1)C(=O)NC1CCCC1
InChIInChI=1S/C13H16N2O3/c16-11-7-3-6-10(8-11)15-13(18)12(17)14-9-4-1-2-5-9/h3,6-9,16H,1-2,4-5H2,(H,14,17)(H,15,18)
InChIKeyTWFZDDNUFMBSHJ-UHFFFAOYSA-N
XLogP1.39
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.28
LogP ≤ 51.39
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-cyclohexyl-N'-phenyloxamide
CID 2271218
N-cyclopentyl-N'-(3-methoxyphenyl)oxamide
CID 7541556
N-cyclohexyl-N'-(3-methylsulfanylphenyl)oxamide
CID 18588616
N-cyclopentyl-N'-(3,4-dichlorophenyl)oxamide
CID 2059042
N-cyclohexyl-N'-(3,4-dichlorophenyl)oxamide
CID 2058101
(Z)-2-cyano-3-(cyclohexylamino)-N-(3-hydroxyphenyl)prop-2-enamide
CID 108816837
N-cycloheptyl-N'-(2,6-dimethylphenyl)oxamide
CID 7541637
N-(3-hydroxyphenyl)-N'-(3-methylphenyl)oxamide
CID 10445826
N-cycloheptyl-N'-(4-methylphenyl)oxamide
CID 2287607
N-cyclododecyl-N'-(4-methylphenyl)oxamide
CID 2924110
N-cyclohexyl-2-oxo-2-(2-phenylhydrazinyl)acetamide
CID 3608144
N-cycloheptyl-N'-(3-fluoro-4-methylphenyl)oxamide
CID 7585166

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-N'-(3-hydroxyphenyl)oxamide?
The IUPAC name of N-cyclopentyl-N'-(3-hydroxyphenyl)oxamide (CID 44995644) is N-cyclopentyl-N'-(3-hydroxyphenyl)oxamide.
What is the SMILES notation for N-cyclopentyl-N'-(3-hydroxyphenyl)oxamide?
The canonical SMILES for N-cyclopentyl-N'-(3-hydroxyphenyl)oxamide is O=C(Nc1cccc(O)c1)C(=O)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-N'-(3-hydroxyphenyl)oxamide?
The InChIKey is TWFZDDNUFMBSHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O3/c16-11-7-3-6-10(8-11)15-13(18)12(17)14-9-4-1-2-5-9/h3,6-9,16H,1-2,4-5H2,(H,14,17)(H,15,18).
What are the key properties of N-cyclopentyl-N'-(3-hydroxyphenyl)oxamide?
N-cyclopentyl-N'-(3-hydroxyphenyl)oxamide has a molecular weight of 248.28 g/mol, XLogP of 1.39, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-N'-(3-hydroxyphenyl)oxamide is sourced from PubChem (CID 44995644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).