1-(4-chlorophenyl)-N-(2-oxo-3H-1,3-benzoxazol-5-yl)cyclopentane-1-carboxamide

C19H17ClN2O3 — CID 134019851

IUPAC1-(4-chlorophenyl)-N-(2-oxo-3H-1,3-benzoxazol-5-yl)cyclopentane-1-carboxamide
SMILESO=C(Nc1ccc2oc(=O)[nH]c2c1)C1(c2ccc(Cl)cc2)CCCC1
InChIInChI=1S/C19H17ClN2O3/c20-13-5-3-12(4-6-13)19(9-1-2-10-19)17(23)21-14-7-8-16-15(11-14)22-18(24)25-16/h3-8,11H,1-2,9-10H2,(H,21,23)(H,22,24)
InChIKeyFQFCPQBPKGZHMW-UHFFFAOYSA-N
MW356.81 g/mol
LogP4.22
Rot. Bonds3

About 1-(4-chlorophenyl)-N-(2-oxo-3H-1,3-benzoxazol-5-yl)cyclopentane-1-carboxamide

1-(4-chlorophenyl)-N-(2-oxo-3H-1,3-benzoxazol-5-yl)cyclopentane-1-carboxamide (PubChem CID 134019851) has the molecular formula C19H17ClN2O3 and a molecular weight of 356.81 g/mol. Its IUPAC name is 1-(4-chlorophenyl)-N-(2-oxo-3H-1,3-benzoxazol-5-yl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-(4-chlorophenyl)-N-(2-oxo-3H-1,3-benzoxazol-5-yl)cyclopentane-1-carboxamide
PubChem CID134019851
Molecular FormulaC19H17ClN2O3
Molecular Weight356.81 g/mol
Exact Mass356.09
IUPAC Name1-(4-chlorophenyl)-N-(2-oxo-3H-1,3-benzoxazol-5-yl)cyclopentane-1-carboxamide
SMILESO=C(Nc1ccc2oc(=O)[nH]c2c1)C1(c2ccc(Cl)cc2)CCCC1
InChIInChI=1S/C19H17ClN2O3/c20-13-5-3-12(4-6-13)19(9-1-2-10-19)17(23)21-14-7-8-16-15(11-14)22-18(24)25-16/h3-8,11H,1-2,9-10H2,(H,21,23)(H,22,24)
InChIKeyFQFCPQBPKGZHMW-UHFFFAOYSA-N
XLogP4.22
TPSA75.10 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.81
LogP ≤ 54.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(3-fluorophenyl)-N-(2-oxo-3H-1,3-benzoxazol-5-yl)oxane-4-carboxamide
CID 51125644
2-(2,4-dichlorophenyl)-N-(2-oxo-3H-1,3-benzoxazol-5-yl)acetamide
CID 37091055
1-(4-chlorophenyl)-N-phenylcyclopentane-1-carboxamide
CID 22236982
2-[1-(aminomethyl)cyclobutyl]-N-(2-oxo-3H-1,3-benzoxazol-5-yl)acetamide
CID 81179560
2-amino-1-methyl-N-(2-oxo-3H-1,3-benzoxazol-5-yl)cyclopentane-1-carboxamide
CID 82764078
1-(4-chlorophenyl)-N-(2-methyl-1,3-benzoxazol-5-yl)cyclopropane-1-carboxamide
CID 37040333
N-(2-tert-butyl-2,3-dihydro-1H-indol-5-yl)-1-(2-oxo-3H-1,3-benzoxazol-5-yl)cyclopropane-1-carboxamide
CID 121258460
1-(benzylcarbamoylamino)-N-(2-oxo-3H-1,3-benzoxazol-5-yl)cyclopentane-1-carboxamide
CID 134019994
5-chloro-N-(2-oxo-3H-1,3-benzoxazol-5-yl)-1-benzofuran-2-carboxamide
CID 134019812
4-oxo-4-[(2-oxo-3H-1,3-benzoxazol-5-yl)amino]butanoic acid
CID 12925401
2-chloro-5-[[1-(4-chlorophenyl)cyclobutanecarbonyl]amino]-N,N-dimethylbenzamide
CID 55674742
1-(4-chlorophenyl)-N-(4-methylsulfanylphenyl)cyclobutane-1-carboxamide
CID 55415843

Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)-N-(2-oxo-3H-1,3-benzoxazol-5-yl)cyclopentane-1-carboxamide?
The IUPAC name of 1-(4-chlorophenyl)-N-(2-oxo-3H-1,3-benzoxazol-5-yl)cyclopentane-1-carboxamide (CID 134019851) is 1-(4-chlorophenyl)-N-(2-oxo-3H-1,3-benzoxazol-5-yl)cyclopentane-1-carboxamide.
What is the SMILES notation for 1-(4-chlorophenyl)-N-(2-oxo-3H-1,3-benzoxazol-5-yl)cyclopentane-1-carboxamide?
The canonical SMILES for 1-(4-chlorophenyl)-N-(2-oxo-3H-1,3-benzoxazol-5-yl)cyclopentane-1-carboxamide is O=C(Nc1ccc2oc(=O)[nH]c2c1)C1(c2ccc(Cl)cc2)CCCC1.
What is the InChIKey of 1-(4-chlorophenyl)-N-(2-oxo-3H-1,3-benzoxazol-5-yl)cyclopentane-1-carboxamide?
The InChIKey is FQFCPQBPKGZHMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17ClN2O3/c20-13-5-3-12(4-6-13)19(9-1-2-10-19)17(23)21-14-7-8-16-15(11-14)22-18(24)25-16/h3-8,11H,1-2,9-10H2,(H,21,23)(H,22,24).
What are the key properties of 1-(4-chlorophenyl)-N-(2-oxo-3H-1,3-benzoxazol-5-yl)cyclopentane-1-carboxamide?
1-(4-chlorophenyl)-N-(2-oxo-3H-1,3-benzoxazol-5-yl)cyclopentane-1-carboxamide has a molecular weight of 356.81 g/mol, XLogP of 4.22, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)-N-(2-oxo-3H-1,3-benzoxazol-5-yl)cyclopentane-1-carboxamide is sourced from PubChem (CID 134019851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).