N-(2-chlorophenyl)naphthalene-2-carboxamide

C17H12ClNO — CID 832568

IUPACN-(2-chlorophenyl)naphthalene-2-carboxamide
SMILESO=C(Nc1ccccc1Cl)c1ccc2ccccc2c1
InChIInChI=1S/C17H12ClNO/c18-15-7-3-4-8-16(15)19-17(20)14-10-9-12-5-1-2-6-13(12)11-14/h1-11H,(H,19,20)
InChIKeyOTZZLIZWFQIEGC-UHFFFAOYSA-N
MW281.74 g/mol
LogP4.75
Rot. Bonds2

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

N-(2-chlorophenyl)naphthalene-2-carboxamide (PubChem CID 832568) has the molecular formula C17H12ClNO and a molecular weight of 281.74 g/mol. Its IUPAC name is N-(2-chlorophenyl)naphthalene-2-carboxamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)naphthalene-2-carboxamide
PubChem CID832568
Molecular FormulaC17H12ClNO
Molecular Weight281.74 g/mol
Exact Mass281.06
IUPAC NameN-(2-chlorophenyl)naphthalene-2-carboxamide
SMILESO=C(Nc1ccccc1Cl)c1ccc2ccccc2c1
InChIInChI=1S/C17H12ClNO/c18-15-7-3-4-8-16(15)19-17(20)14-10-9-12-5-1-2-6-13(12)11-14/h1-11H,(H,19,20)
InChIKeyOTZZLIZWFQIEGC-UHFFFAOYSA-N
XLogP4.75
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.74
LogP ≤ 54.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)naphthalene-2-carboxamide?
The IUPAC name of N-(2-chlorophenyl)naphthalene-2-carboxamide (CID 832568) is N-(2-chlorophenyl)naphthalene-2-carboxamide.
What is the SMILES notation for N-(2-chlorophenyl)naphthalene-2-carboxamide?
The canonical SMILES for N-(2-chlorophenyl)naphthalene-2-carboxamide is O=C(Nc1ccccc1Cl)c1ccc2ccccc2c1.
What is the InChIKey of N-(2-chlorophenyl)naphthalene-2-carboxamide?
The InChIKey is OTZZLIZWFQIEGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12ClNO/c18-15-7-3-4-8-16(15)19-17(20)14-10-9-12-5-1-2-6-13(12)11-14/h1-11H,(H,19,20).
What are the key properties of N-(2-chlorophenyl)naphthalene-2-carboxamide?
N-(2-chlorophenyl)naphthalene-2-carboxamide has a molecular weight of 281.74 g/mol, XLogP of 4.75, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)naphthalene-2-carboxamide is sourced from PubChem (CID 832568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).