N-(2-chlorophenyl)-N-hydroxynaphthalene-2-carboxamide

C17H12ClNO2 — CID 87770632

IUPACN-(2-chlorophenyl)-N-hydroxynaphthalene-2-carboxamide
SMILESO=C(c1ccc2ccccc2c1)N(O)c1ccccc1Cl
InChIInChI=1S/C17H12ClNO2/c18-15-7-3-4-8-16(15)19(21)17(20)14-10-9-12-5-1-2-6-13(12)11-14/h1-11,21H
InChIKeyBRRWEABVNLQHID-UHFFFAOYSA-N
MW297.74 g/mol
LogP4.53
Rot. Bonds2

About N-(2-chlorophenyl)-N-hydroxynaphthalene-2-carboxamide

N-(2-chlorophenyl)-N-hydroxynaphthalene-2-carboxamide (PubChem CID 87770632) has the molecular formula C17H12ClNO2 and a molecular weight of 297.74 g/mol. Its IUPAC name is N-(2-chlorophenyl)-N-hydroxynaphthalene-2-carboxamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-N-hydroxynaphthalene-2-carboxamide
PubChem CID87770632
Molecular FormulaC17H12ClNO2
Molecular Weight297.74 g/mol
Exact Mass297.06
IUPAC NameN-(2-chlorophenyl)-N-hydroxynaphthalene-2-carboxamide
SMILESO=C(c1ccc2ccccc2c1)N(O)c1ccccc1Cl
InChIInChI=1S/C17H12ClNO2/c18-15-7-3-4-8-16(15)19(21)17(20)14-10-9-12-5-1-2-6-13(12)11-14/h1-11,21H
InChIKeyBRRWEABVNLQHID-UHFFFAOYSA-N
XLogP4.53
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.74
LogP ≤ 54.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-N-hydroxynaphthalene-2-carboxamide?
The IUPAC name of N-(2-chlorophenyl)-N-hydroxynaphthalene-2-carboxamide (CID 87770632) is N-(2-chlorophenyl)-N-hydroxynaphthalene-2-carboxamide.
What is the SMILES notation for N-(2-chlorophenyl)-N-hydroxynaphthalene-2-carboxamide?
The canonical SMILES for N-(2-chlorophenyl)-N-hydroxynaphthalene-2-carboxamide is O=C(c1ccc2ccccc2c1)N(O)c1ccccc1Cl.
What is the InChIKey of N-(2-chlorophenyl)-N-hydroxynaphthalene-2-carboxamide?
The InChIKey is BRRWEABVNLQHID-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12ClNO2/c18-15-7-3-4-8-16(15)19(21)17(20)14-10-9-12-5-1-2-6-13(12)11-14/h1-11,21H.
What are the key properties of N-(2-chlorophenyl)-N-hydroxynaphthalene-2-carboxamide?
N-(2-chlorophenyl)-N-hydroxynaphthalene-2-carboxamide has a molecular weight of 297.74 g/mol, XLogP of 4.53, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-N-hydroxynaphthalene-2-carboxamide is sourced from PubChem (CID 87770632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).