2-[(4-methoxybenzoyl)hydrazinylidene]chromene-3-carboxamide

C18H15N3O4 — CID 3459938

IUPAC2-[(4-methoxybenzoyl)hydrazinylidene]chromene-3-carboxamide
SMILESCOc1ccc(C(=O)NN=c2oc3ccccc3cc2C(N)=O)cc1
InChIInChI=1S/C18H15N3O4/c1-24-13-8-6-11(7-9-13)17(23)20-21-18-14(16(19)22)10-12-4-2-3-5-15(12)25-18/h2-10H,1H3,(H2,19,22)(H,20,23)
InChIKeySUYZCPJCIOTLHK-UHFFFAOYSA-N
MW337.34 g/mol
LogP1.79
Rot. Bonds4

About 2-[(4-methoxybenzoyl)hydrazinylidene]chromene-3-carboxamide

2-[(4-methoxybenzoyl)hydrazinylidene]chromene-3-carboxamide (PubChem CID 3459938) has the molecular formula C18H15N3O4 and a molecular weight of 337.34 g/mol. Its IUPAC name is 2-[(4-methoxybenzoyl)hydrazinylidene]chromene-3-carboxamide.

Molecular Properties

Compound Name2-[(4-methoxybenzoyl)hydrazinylidene]chromene-3-carboxamide
PubChem CID3459938
Molecular FormulaC18H15N3O4
Molecular Weight337.34 g/mol
Exact Mass337.11
IUPAC Name2-[(4-methoxybenzoyl)hydrazinylidene]chromene-3-carboxamide
SMILESCOc1ccc(C(=O)NN=c2oc3ccccc3cc2C(N)=O)cc1
InChIInChI=1S/C18H15N3O4/c1-24-13-8-6-11(7-9-13)17(23)20-21-18-14(16(19)22)10-12-4-2-3-5-15(12)25-18/h2-10H,1H3,(H2,19,22)(H,20,23)
InChIKeySUYZCPJCIOTLHK-UHFFFAOYSA-N
XLogP1.79
TPSA106.92 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.34
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2-[(4-methoxybenzoyl)hydrazinylidene]chromene-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2E)-2-[(4-ethoxybenzoyl)hydrazinylidene]chromene-3-carboxamide
CID 95796044
2-[(4-fluorobenzoyl)hydrazinylidene]chromene-3-carboxamide
CID 5186461
(2Z)-2-[(4-bromobenzoyl)hydrazinylidene]chromene-3-carboxamide
CID 21239666
6-methoxy-2-[(4-nitrobenzoyl)hydrazinylidene]chromene-3-carboxamide
CID 3576903
2-(carbamothioylhydrazinylidene)-6-methoxychromene-3-carboxamide
CID 4133031
2-(furan-2-carbonylhydrazinylidene)-7-methoxychromene-3-carboxamide
CID 5201553
2-[(3-nitrobenzoyl)hydrazinylidene]chromene-3-carboxamide
CID 3876523
N-[(E)-(3-carbamoylchromen-2-ylidene)amino]-3-(4-ethoxyphenyl)-1H-pyrazole-5-carboxamide
CID 95796047
2-(4-carbamoylphenyl)imino-N-(4-methoxyphenyl)chromene-3-carboxamide
CID 51368024
[(3-acetylchromen-2-ylidene)amino]thiourea
CID 123442126
N-[2-[(4-methoxybenzoyl)amino]ethyl]-1-benzofuran-2-carboxamide
CID 71480807
2-[(3-chlorobenzoyl)hydrazinylidene]-8-methoxychromene-3-carboxamide
CID 39844710

Frequently Asked Questions

What is the IUPAC name of 2-[(4-methoxybenzoyl)hydrazinylidene]chromene-3-carboxamide?
The IUPAC name of 2-[(4-methoxybenzoyl)hydrazinylidene]chromene-3-carboxamide (CID 3459938) is 2-[(4-methoxybenzoyl)hydrazinylidene]chromene-3-carboxamide.
What is the SMILES notation for 2-[(4-methoxybenzoyl)hydrazinylidene]chromene-3-carboxamide?
The canonical SMILES for 2-[(4-methoxybenzoyl)hydrazinylidene]chromene-3-carboxamide is COc1ccc(C(=O)NN=c2oc3ccccc3cc2C(N)=O)cc1.
What is the InChIKey of 2-[(4-methoxybenzoyl)hydrazinylidene]chromene-3-carboxamide?
The InChIKey is SUYZCPJCIOTLHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N3O4/c1-24-13-8-6-11(7-9-13)17(23)20-21-18-14(16(19)22)10-12-4-2-3-5-15(12)25-18/h2-10H,1H3,(H2,19,22)(H,20,23).
What are the key properties of 2-[(4-methoxybenzoyl)hydrazinylidene]chromene-3-carboxamide?
2-[(4-methoxybenzoyl)hydrazinylidene]chromene-3-carboxamide has a molecular weight of 337.34 g/mol, XLogP of 1.79, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-methoxybenzoyl)hydrazinylidene]chromene-3-carboxamide is sourced from PubChem (CID 3459938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).