N-[5-chloro-2-(5-oxo-4H-1,2,4-oxadiazol-3-yl)phenyl]naphthalene-2-carboxamide

C19H12ClN3O3 — CID 135896368

IUPACN-[5-chloro-2-(5-oxo-4H-1,2,4-oxadiazol-3-yl)phenyl]naphthalene-2-carboxamide
SMILESO=C(Nc1cc(Cl)ccc1-c1noc(=O)[nH]1)c1ccc2ccccc2c1
InChIInChI=1S/C19H12ClN3O3/c20-14-7-8-15(17-22-19(25)26-23-17)16(10-14)21-18(24)13-6-5-11-3-1-2-4-12(11)9-13/h1-10H,(H,21,24)(H,22,23,25)
InChIKeyIQOWMAGETUOQDE-UHFFFAOYSA-N
MW365.78 g/mol
LogP4.09
Rot. Bonds3

About N-[5-chloro-2-(5-oxo-4H-1,2,4-oxadiazol-3-yl)phenyl]naphthalene-2-carboxamide

N-[5-chloro-2-(5-oxo-4H-1,2,4-oxadiazol-3-yl)phenyl]naphthalene-2-carboxamide (PubChem CID 135896368) has the molecular formula C19H12ClN3O3 and a molecular weight of 365.78 g/mol. Its IUPAC name is N-[5-chloro-2-(5-oxo-4H-1,2,4-oxadiazol-3-yl)phenyl]naphthalene-2-carboxamide.

Molecular Properties

Compound NameN-[5-chloro-2-(5-oxo-4H-1,2,4-oxadiazol-3-yl)phenyl]naphthalene-2-carboxamide
PubChem CID135896368
Molecular FormulaC19H12ClN3O3
Molecular Weight365.78 g/mol
Exact Mass365.06
IUPAC NameN-[5-chloro-2-(5-oxo-4H-1,2,4-oxadiazol-3-yl)phenyl]naphthalene-2-carboxamide
SMILESO=C(Nc1cc(Cl)ccc1-c1noc(=O)[nH]1)c1ccc2ccccc2c1
InChIInChI=1S/C19H12ClN3O3/c20-14-7-8-15(17-22-19(25)26-23-17)16(10-14)21-18(24)13-6-5-11-3-1-2-4-12(11)9-13/h1-10H,(H,21,24)(H,22,23,25)
InChIKeyIQOWMAGETUOQDE-UHFFFAOYSA-N
XLogP4.09
TPSA87.99 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.78
LogP ≤ 54.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[5-chloro-2-(5-oxo-4H-1,2,4-oxadiazol-3-yl)phenyl]-4-methoxybenzamide
CID 135895153
6-fluoro-N-[4-fluoro-5-methoxy-2-(5-oxo-4H-1,2,4-oxadiazol-3-yl)phenyl]naphthalene-2-carboxamide
CID 137256011
N-[4-(naphthalene-2-carbonylamino)phenyl]naphthalene-2-carboxamide
CID 5120135
4-(5-oxo-4H-1,2,4-oxadiazol-3-yl)-N-phenylbenzamide
CID 167966446
N-(2-fluorophenyl)naphthalene-2-carboxamide
CID 883701
N-[5-chloro-2-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]naphthalene-2-carboxamide
CID 17066078
N-[3-[(3-chlorobenzoyl)amino]phenyl]naphthalene-2-carboxamide
CID 1366118
N-[5-amino-2-(4-oxo-3,1-benzoxazin-2-yl)phenyl]naphthalene-2-carboxamide
CID 143844182
N-(2-acetamidophenyl)naphthalene-2-carboxamide
CID 787693
N-(2-methylphenyl)naphthalene-2-carboxamide
CID 790563
N-(2-sulfanylphenyl)naphthalene-2-carboxamide
CID 23961098
N-(1H-pyrazol-5-yl)naphthalene-2-carboxamide
CID 61393106

Frequently Asked Questions

What is the IUPAC name of N-[5-chloro-2-(5-oxo-4H-1,2,4-oxadiazol-3-yl)phenyl]naphthalene-2-carboxamide?
The IUPAC name of N-[5-chloro-2-(5-oxo-4H-1,2,4-oxadiazol-3-yl)phenyl]naphthalene-2-carboxamide (CID 135896368) is N-[5-chloro-2-(5-oxo-4H-1,2,4-oxadiazol-3-yl)phenyl]naphthalene-2-carboxamide.
What is the SMILES notation for N-[5-chloro-2-(5-oxo-4H-1,2,4-oxadiazol-3-yl)phenyl]naphthalene-2-carboxamide?
The canonical SMILES for N-[5-chloro-2-(5-oxo-4H-1,2,4-oxadiazol-3-yl)phenyl]naphthalene-2-carboxamide is O=C(Nc1cc(Cl)ccc1-c1noc(=O)[nH]1)c1ccc2ccccc2c1.
What is the InChIKey of N-[5-chloro-2-(5-oxo-4H-1,2,4-oxadiazol-3-yl)phenyl]naphthalene-2-carboxamide?
The InChIKey is IQOWMAGETUOQDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12ClN3O3/c20-14-7-8-15(17-22-19(25)26-23-17)16(10-14)21-18(24)13-6-5-11-3-1-2-4-12(11)9-13/h1-10H,(H,21,24)(H,22,23,25).
What are the key properties of N-[5-chloro-2-(5-oxo-4H-1,2,4-oxadiazol-3-yl)phenyl]naphthalene-2-carboxamide?
N-[5-chloro-2-(5-oxo-4H-1,2,4-oxadiazol-3-yl)phenyl]naphthalene-2-carboxamide has a molecular weight of 365.78 g/mol, XLogP of 4.09, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-chloro-2-(5-oxo-4H-1,2,4-oxadiazol-3-yl)phenyl]naphthalene-2-carboxamide is sourced from PubChem (CID 135896368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).