4-[(2-hydroxyphenyl)methylideneamino]-N-(2-methoxyphenyl)-1-methylpyrazole-5-carboxamide

C19H18N4O3 — CID 1100740

IUPAC4-[(2-hydroxyphenyl)methylideneamino]-N-(2-methoxyphenyl)-1-methylpyrazole-5-carboxamide
SMILESCOc1ccccc1NC(=O)c1c(/N=C/c2ccccc2O)cnn1C
InChIInChI=1S/C19H18N4O3/c1-23-18(19(25)22-14-8-4-6-10-17(14)26-2)15(12-21-23)20-11-13-7-3-5-9-16(13)24/h3-12,24H,1-2H3,(H,22,25)/b20-11+
InChIKeyVZCZPDQJDSDGQM-RGVLZGJSSA-N
MW350.38 g/mol
LogP3.14
Rot. Bonds5

About 4-[(2-hydroxyphenyl)methylideneamino]-N-(2-methoxyphenyl)-1-methylpyrazole-5-carboxamide

4-[(2-hydroxyphenyl)methylideneamino]-N-(2-methoxyphenyl)-1-methylpyrazole-5-carboxamide (PubChem CID 1100740) has the molecular formula C19H18N4O3 and a molecular weight of 350.38 g/mol. Its IUPAC name is 4-[(2-hydroxyphenyl)methylideneamino]-N-(2-methoxyphenyl)-1-methylpyrazole-5-carboxamide.

Molecular Properties

Compound Name4-[(2-hydroxyphenyl)methylideneamino]-N-(2-methoxyphenyl)-1-methylpyrazole-5-carboxamide
PubChem CID1100740
Molecular FormulaC19H18N4O3
Molecular Weight350.38 g/mol
Exact Mass350.14
IUPAC Name4-[(2-hydroxyphenyl)methylideneamino]-N-(2-methoxyphenyl)-1-methylpyrazole-5-carboxamide
SMILESCOc1ccccc1NC(=O)c1c(/N=C/c2ccccc2O)cnn1C
InChIInChI=1S/C19H18N4O3/c1-23-18(19(25)22-14-8-4-6-10-17(14)26-2)15(12-21-23)20-11-13-7-3-5-9-16(13)24/h3-12,24H,1-2H3,(H,22,25)/b20-11+
InChIKeyVZCZPDQJDSDGQM-RGVLZGJSSA-N
XLogP3.14
TPSA88.74 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.38
LogP ≤ 53.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

N-(2-methoxy-5-methylphenyl)-1-methyl-4-nitro-1H-pyrazole-5-carboxamide
CID 690237
1-ethyl-N-(2-methoxyphenyl)-1H-pyrazole-5-carboxamide
CID 892441
4-methoxy-N-(2-methoxy-5-methylphenyl)-1-phenylpyrazole-3-carboxamide
CID 7992588
5-(4-methoxybenzyl)-4-oxo-N-phenyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-3-carboxamide
CID 1474584
N-(2-methoxyphenyl)-2-methyl-4-[(2-oxo-1-naphthalenylidene)methylamino]-3-pyrazolecarboxamide
CID 1894170
N-(2-methoxyphenyl)-2-methyl-4-nitropyrazole-3-carboxamide
CID 839993
4-Amino-2-methyl-2H-pyrazole-3-carboxylic acid (4-methoxy-phenyl)-amide
CID 913152
N-(2-methoxyphenyl)-2-methyl-4-[(3-nitrophenyl)methylideneamino]pyrazole-3-carboxamide
CID 1230027
1-(2-ethylphenyl)-N-(2-methoxyphenyl)-5-methyl-1H-pyrazole-4-carboxamide
CID 1235418
(6E)-6-[[[1-methyl-5-(morpholine-4-carbonyl)pyrazol-4-yl]amino]methylidene]cyclohexa-2,4-dien-1-one
CID 658220
1-benzyl-4-fluoro-N-[(3S)-5-methyl-4-oxo-2,3-dihydro-1,5-benzoxazepin-3-yl]pyrazole-3-carboxamide
CID 130299021
N-[2-(cyclohexylamino)-2-oxoethyl]-N-(2-methoxyphenyl)-1-propan-2-ylpyrazole-4-carboxamide
CID 650559

Frequently Asked Questions

What is the IUPAC name of 4-[(2-hydroxyphenyl)methylideneamino]-N-(2-methoxyphenyl)-1-methylpyrazole-5-carboxamide?
The IUPAC name of 4-[(2-hydroxyphenyl)methylideneamino]-N-(2-methoxyphenyl)-1-methylpyrazole-5-carboxamide (CID 1100740) is 4-[(2-hydroxyphenyl)methylideneamino]-N-(2-methoxyphenyl)-1-methylpyrazole-5-carboxamide.
What is the SMILES notation for 4-[(2-hydroxyphenyl)methylideneamino]-N-(2-methoxyphenyl)-1-methylpyrazole-5-carboxamide?
The canonical SMILES for 4-[(2-hydroxyphenyl)methylideneamino]-N-(2-methoxyphenyl)-1-methylpyrazole-5-carboxamide is COc1ccccc1NC(=O)c1c(/N=C/c2ccccc2O)cnn1C.
What is the InChIKey of 4-[(2-hydroxyphenyl)methylideneamino]-N-(2-methoxyphenyl)-1-methylpyrazole-5-carboxamide?
The InChIKey is VZCZPDQJDSDGQM-RGVLZGJSSA-N. The full InChI is InChI=1S/C19H18N4O3/c1-23-18(19(25)22-14-8-4-6-10-17(14)26-2)15(12-21-23)20-11-13-7-3-5-9-16(13)24/h3-12,24H,1-2H3,(H,22,25)/b20-11+.
What are the key properties of 4-[(2-hydroxyphenyl)methylideneamino]-N-(2-methoxyphenyl)-1-methylpyrazole-5-carboxamide?
4-[(2-hydroxyphenyl)methylideneamino]-N-(2-methoxyphenyl)-1-methylpyrazole-5-carboxamide has a molecular weight of 350.38 g/mol, XLogP of 3.14, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-hydroxyphenyl)methylideneamino]-N-(2-methoxyphenyl)-1-methylpyrazole-5-carboxamide is sourced from PubChem (CID 1100740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).