N-(4-hydroxy-3-methylnaphthalen-1-yl)imino-4-methoxybenzamide

C19H16N2O3 — CID 585679

IUPACN-(4-hydroxy-3-methylnaphthalen-1-yl)imino-4-methoxybenzamide
SMILESCOc1ccc(C(=O)/N=N/c2cc(C)c(O)c3ccccc23)cc1
InChIInChI=1S/C19H16N2O3/c1-12-11-17(15-5-3-4-6-16(15)18(12)22)20-21-19(23)13-7-9-14(24-2)10-8-13/h3-11,22H,1-2H3/b21-20+
InChIKeyGSYMWGJTDIXWBO-QZQOTICOSA-N
MW320.35 g/mol
LogP4.79
Rot. Bonds3

About N-(4-hydroxy-3-methylnaphthalen-1-yl)imino-4-methoxybenzamide

N-(4-hydroxy-3-methylnaphthalen-1-yl)imino-4-methoxybenzamide (PubChem CID 585679) has the molecular formula C19H16N2O3 and a molecular weight of 320.35 g/mol. Its IUPAC name is N-(4-hydroxy-3-methylnaphthalen-1-yl)imino-4-methoxybenzamide.

Molecular Properties

Compound NameN-(4-hydroxy-3-methylnaphthalen-1-yl)imino-4-methoxybenzamide
PubChem CID585679
Molecular FormulaC19H16N2O3
Molecular Weight320.35 g/mol
Exact Mass320.12
IUPAC NameN-(4-hydroxy-3-methylnaphthalen-1-yl)imino-4-methoxybenzamide
SMILESCOc1ccc(C(=O)/N=N/c2cc(C)c(O)c3ccccc23)cc1
InChIInChI=1S/C19H16N2O3/c1-12-11-17(15-5-3-4-6-16(15)18(12)22)20-21-19(23)13-7-9-14(24-2)10-8-13/h3-11,22H,1-2H3/b21-20+
InChIKeyGSYMWGJTDIXWBO-QZQOTICOSA-N
XLogP4.79
TPSA71.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.35
LogP ≤ 54.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

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Related Compounds

N-[1-hydroxy-4-[(4-methoxyphenyl)sulfonylamino]naphthalen-2-yl]imino-4-methoxybenzamide
CID 3487122
ethyl 2-[2-hydroxy-3-[(4-methoxybenzoyl)diazenyl]indol-1-yl]acetate
CID 135784384
methyl 2-[2-hydroxy-3-[(4-methoxybenzoyl)diazenyl]indol-1-yl]acetate
CID 1270570
N-(2,4-dihydroxy-3-methylnaphthalen-1-yl)iminobenzamide
CID 570072
N-[(2-hydroxy-7-methyl-1H-indol-3-yl)imino]-3,5-dimethoxybenzamide
CID 135582404
(1-hydroxy-6-methoxynaphthalen-2-yl)iminourea
CID 135910248
[3-methyl-4-(naphthalen-2-yldiazenyl)phenyl] 4-methoxybenzoate
CID 101055785
N-(1-ethyl-2-hydroxy-5-methoxyindol-3-yl)imino-4-methylbenzamide
CID 4504817
methyl N-(5-methoxy-2-methylphenyl)iminocarbamate
CID 155908077
acetic acid;2-methylnaphthalene-1,4-diol
CID 57358360
N-[2-hydroxy-5-methoxy-1-(3-methylbutyl)indol-3-yl]iminobenzamide
CID 4507272
(E)-3-hydroxy-2-[(4-methoxyphenyl)diazenyl]-1-phenylprop-2-en-1-one
CID 135548536

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxy-3-methylnaphthalen-1-yl)imino-4-methoxybenzamide?
The IUPAC name of N-(4-hydroxy-3-methylnaphthalen-1-yl)imino-4-methoxybenzamide (CID 585679) is N-(4-hydroxy-3-methylnaphthalen-1-yl)imino-4-methoxybenzamide.
What is the SMILES notation for N-(4-hydroxy-3-methylnaphthalen-1-yl)imino-4-methoxybenzamide?
The canonical SMILES for N-(4-hydroxy-3-methylnaphthalen-1-yl)imino-4-methoxybenzamide is COc1ccc(C(=O)/N=N/c2cc(C)c(O)c3ccccc23)cc1.
What is the InChIKey of N-(4-hydroxy-3-methylnaphthalen-1-yl)imino-4-methoxybenzamide?
The InChIKey is GSYMWGJTDIXWBO-QZQOTICOSA-N. The full InChI is InChI=1S/C19H16N2O3/c1-12-11-17(15-5-3-4-6-16(15)18(12)22)20-21-19(23)13-7-9-14(24-2)10-8-13/h3-11,22H,1-2H3/b21-20+.
What are the key properties of N-(4-hydroxy-3-methylnaphthalen-1-yl)imino-4-methoxybenzamide?
N-(4-hydroxy-3-methylnaphthalen-1-yl)imino-4-methoxybenzamide has a molecular weight of 320.35 g/mol, XLogP of 4.79, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxy-3-methylnaphthalen-1-yl)imino-4-methoxybenzamide is sourced from PubChem (CID 585679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).