N-(2-chlorophenyl)-4-methoxynaphthalene-1-carboxamide

C18H14ClNO2 — CID 110169740

IUPACN-(2-chlorophenyl)-4-methoxynaphthalene-1-carboxamide
SMILESCOc1ccc(C(=O)Nc2ccccc2Cl)c2ccccc12
InChIInChI=1S/C18H14ClNO2/c1-22-17-11-10-14(12-6-2-3-7-13(12)17)18(21)20-16-9-5-4-8-15(16)19/h2-11H,1H3,(H,20,21)
InChIKeyHBJQPRCDOTZFCF-UHFFFAOYSA-N
MW311.77 g/mol
LogP4.75
Rot. Bonds3

About N-(2-chlorophenyl)-4-methoxynaphthalene-1-carboxamide

N-(2-chlorophenyl)-4-methoxynaphthalene-1-carboxamide (PubChem CID 110169740) has the molecular formula C18H14ClNO2 and a molecular weight of 311.77 g/mol. Its IUPAC name is N-(2-chlorophenyl)-4-methoxynaphthalene-1-carboxamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-4-methoxynaphthalene-1-carboxamide
PubChem CID110169740
Molecular FormulaC18H14ClNO2
Molecular Weight311.77 g/mol
Exact Mass311.07
IUPAC NameN-(2-chlorophenyl)-4-methoxynaphthalene-1-carboxamide
SMILESCOc1ccc(C(=O)Nc2ccccc2Cl)c2ccccc12
InChIInChI=1S/C18H14ClNO2/c1-22-17-11-10-14(12-6-2-3-7-13(12)17)18(21)20-16-9-5-4-8-15(16)19/h2-11H,1H3,(H,20,21)
InChIKeyHBJQPRCDOTZFCF-UHFFFAOYSA-N
XLogP4.75
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.77
LogP ≤ 54.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-chloro-N-(2-chlorophenyl)-3-methoxybenzamide
CID 45051392
N-(2-chlorophenyl)-2,4,5-trimethoxybenzamide
CID 912702
4-bromo-N-(2-chlorophenyl)-2-methoxybenzamide
CID 78987594
5-bromo-N-(2-chlorophenyl)-2-methoxybenzamide
CID 1121307
[2-[(2-chlorophenyl)carbamoyl]-4-methoxynaphthalen-1-yl] N-phenylcarbamate
CID 58833963
N-(2,6-dichlorophenyl)-2,3,4-trimethoxybenzamide
CID 2347602
methyl 2-[(5-chloronaphthalene-1-carbonyl)amino]benzoate
CID 17102102
N-cyclopropyl-4-methoxynaphthalene-1-carboxamide
CID 27537333
N-(2-chlorophenyl)-2-hydroxy-6-methoxybenzamide
CID 84579322
5-chloro-N-(2,4-dimethoxyphenyl)naphthalene-1-carboxamide
CID 17101910
[1-(2-chloroanilino)-1-oxopropan-2-yl] 2,3,4-trimethoxybenzoate
CID 46619461
3,5-dibromo-N-(2-chlorophenyl)-2-methoxybenzamide
CID 22777208

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-4-methoxynaphthalene-1-carboxamide?
The IUPAC name of N-(2-chlorophenyl)-4-methoxynaphthalene-1-carboxamide (CID 110169740) is N-(2-chlorophenyl)-4-methoxynaphthalene-1-carboxamide.
What is the SMILES notation for N-(2-chlorophenyl)-4-methoxynaphthalene-1-carboxamide?
The canonical SMILES for N-(2-chlorophenyl)-4-methoxynaphthalene-1-carboxamide is COc1ccc(C(=O)Nc2ccccc2Cl)c2ccccc12.
What is the InChIKey of N-(2-chlorophenyl)-4-methoxynaphthalene-1-carboxamide?
The InChIKey is HBJQPRCDOTZFCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14ClNO2/c1-22-17-11-10-14(12-6-2-3-7-13(12)17)18(21)20-16-9-5-4-8-15(16)19/h2-11H,1H3,(H,20,21).
What are the key properties of N-(2-chlorophenyl)-4-methoxynaphthalene-1-carboxamide?
N-(2-chlorophenyl)-4-methoxynaphthalene-1-carboxamide has a molecular weight of 311.77 g/mol, XLogP of 4.75, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-4-methoxynaphthalene-1-carboxamide is sourced from PubChem (CID 110169740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).