N-(2-chloro-6-methoxyphenyl)-3-hydroxynaphthalene-2-carboxamide

C18H14ClNO3 — CID 44721323

IUPACN-(2-chloro-6-methoxyphenyl)-3-hydroxynaphthalene-2-carboxamide
SMILESCOc1cccc(Cl)c1NC(=O)c1cc2ccccc2cc1O
InChIInChI=1S/C18H14ClNO3/c1-23-16-8-4-7-14(19)17(16)20-18(22)13-9-11-5-2-3-6-12(11)10-15(13)21/h2-10,21H,1H3,(H,20,22)
InChIKeyVKZCOGFDSNSDSQ-UHFFFAOYSA-N
MW327.77 g/mol
LogP4.46
Rot. Bonds3

About N-(2-chloro-6-methoxyphenyl)-3-hydroxynaphthalene-2-carboxamide

N-(2-chloro-6-methoxyphenyl)-3-hydroxynaphthalene-2-carboxamide (PubChem CID 44721323) has the molecular formula C18H14ClNO3 and a molecular weight of 327.77 g/mol. Its IUPAC name is N-(2-chloro-6-methoxyphenyl)-3-hydroxynaphthalene-2-carboxamide.

Molecular Properties

Compound NameN-(2-chloro-6-methoxyphenyl)-3-hydroxynaphthalene-2-carboxamide
PubChem CID44721323
Molecular FormulaC18H14ClNO3
Molecular Weight327.77 g/mol
Exact Mass327.07
IUPAC NameN-(2-chloro-6-methoxyphenyl)-3-hydroxynaphthalene-2-carboxamide
SMILESCOc1cccc(Cl)c1NC(=O)c1cc2ccccc2cc1O
InChIInChI=1S/C18H14ClNO3/c1-23-16-8-4-7-14(19)17(16)20-18(22)13-9-11-5-2-3-6-12(11)10-15(13)21/h2-10,21H,1H3,(H,20,22)
InChIKeyVKZCOGFDSNSDSQ-UHFFFAOYSA-N
XLogP4.46
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.77
LogP ≤ 54.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

CID 90477654
CID 90477654
N-[2,5-dichloro-4-[(3-hydroxynaphthalene-2-carbonyl)amino]phenyl]-3-hydroxynaphthalene-2-carboxamide
CID 19850925
N-(2,6-dichlorophenyl)-2,6-dimethoxybenzamide
CID 3653582
2-chloro-N-(2-chloro-6-methoxyphenyl)-4-methoxypyrimidine-5-carboxamide
CID 171834988
N-(2-chloro-6-methylphenyl)-2-hydroxy-5-methoxybenzamide
CID 66255339
N-(2,3-dimethoxyphenyl)-3-hydroxynaphthalene-2-carboxamide;3-hydroxy-N-(2-phenoxyphenyl)naphthalene-2-carboxamide
CID 158102212
N-(2,6-dichlorophenyl)-2,3,4-trimethoxybenzamide
CID 2347602
N-(5-tert-butyl-2-methoxyphenyl)-3-hydroxynaphthalene-2-carboxamide
CID 20604815
3-hydroxy-N-[2-methoxy-5-(trifluoromethyl)phenyl]naphthalene-2-carboxamide
CID 20604816
2-chloro-N-(2-chlorophenyl)-3-methoxybenzamide
CID 45051392
3-chloro-4-[[3-[(2-chloro-6-methoxyphenyl)carbamoyl]-2-hydroxynaphthalen-1-yl]diazenyl]-2-ethylbenzenesulfonic acid
CID 136856095
4-chloro-3-[[3-[(2-chloro-6-methoxyphenyl)carbamoyl]-2-hydroxynaphthalen-1-yl]diazenyl]-5-ethylbenzenesulfonic acid
CID 136856111

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-6-methoxyphenyl)-3-hydroxynaphthalene-2-carboxamide?
The IUPAC name of N-(2-chloro-6-methoxyphenyl)-3-hydroxynaphthalene-2-carboxamide (CID 44721323) is N-(2-chloro-6-methoxyphenyl)-3-hydroxynaphthalene-2-carboxamide.
What is the SMILES notation for N-(2-chloro-6-methoxyphenyl)-3-hydroxynaphthalene-2-carboxamide?
The canonical SMILES for N-(2-chloro-6-methoxyphenyl)-3-hydroxynaphthalene-2-carboxamide is COc1cccc(Cl)c1NC(=O)c1cc2ccccc2cc1O.
What is the InChIKey of N-(2-chloro-6-methoxyphenyl)-3-hydroxynaphthalene-2-carboxamide?
The InChIKey is VKZCOGFDSNSDSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14ClNO3/c1-23-16-8-4-7-14(19)17(16)20-18(22)13-9-11-5-2-3-6-12(11)10-15(13)21/h2-10,21H,1H3,(H,20,22).
What are the key properties of N-(2-chloro-6-methoxyphenyl)-3-hydroxynaphthalene-2-carboxamide?
N-(2-chloro-6-methoxyphenyl)-3-hydroxynaphthalene-2-carboxamide has a molecular weight of 327.77 g/mol, XLogP of 4.46, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-6-methoxyphenyl)-3-hydroxynaphthalene-2-carboxamide is sourced from PubChem (CID 44721323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).