6-methoxy-2-oxo-N-(2-propan-2-ylphenyl)chromene-3-carboxamide

C20H19NO4 — CID 19207085

IUPAC6-methoxy-2-oxo-N-(2-propan-2-ylphenyl)chromene-3-carboxamide
SMILESCOc1ccc2oc(=O)c(C(=O)Nc3ccccc3C(C)C)cc2c1
InChIInChI=1S/C20H19NO4/c1-12(2)15-6-4-5-7-17(15)21-19(22)16-11-13-10-14(24-3)8-9-18(13)25-20(16)23/h4-12H,1-3H3,(H,21,22)
InChIKeyBXENASPLDXPGEA-UHFFFAOYSA-N
MW337.38 g/mol
LogP4.18
Rot. Bonds4

About 6-methoxy-2-oxo-N-(2-propan-2-ylphenyl)chromene-3-carboxamide

6-methoxy-2-oxo-N-(2-propan-2-ylphenyl)chromene-3-carboxamide (PubChem CID 19207085) has the molecular formula C20H19NO4 and a molecular weight of 337.38 g/mol. Its IUPAC name is 6-methoxy-2-oxo-N-(2-propan-2-ylphenyl)chromene-3-carboxamide.

Molecular Properties

Compound Name6-methoxy-2-oxo-N-(2-propan-2-ylphenyl)chromene-3-carboxamide
PubChem CID19207085
Molecular FormulaC20H19NO4
Molecular Weight337.38 g/mol
Exact Mass337.13
IUPAC Name6-methoxy-2-oxo-N-(2-propan-2-ylphenyl)chromene-3-carboxamide
SMILESCOc1ccc2oc(=O)c(C(=O)Nc3ccccc3C(C)C)cc2c1
InChIInChI=1S/C20H19NO4/c1-12(2)15-6-4-5-7-17(15)21-19(22)16-11-13-10-14(24-3)8-9-18(13)25-20(16)23/h4-12H,1-3H3,(H,21,22)
InChIKeyBXENASPLDXPGEA-UHFFFAOYSA-N
XLogP4.18
TPSA68.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 6-methoxy-2-oxo-N-(2-propan-2-ylphenyl)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

6-methoxy-N-naphthalen-2-yl-2-oxochromene-3-carboxamide
CID 16645470
N-(2,6-difluorophenyl)-6-methoxy-2-oxochromene-3-carboxamide
CID 4059771
N-(2,5-dichlorophenyl)-6-methoxy-2-oxochromene-3-carboxamide
CID 1337843
2-amino-4-methoxy-N-(2-propan-2-ylphenyl)benzamide
CID 80503097
2-fluoro-4-methoxy-N-(2-propan-2-ylphenyl)benzamide
CID 103602982
6-methoxy-2-oxo-N-pyridin-4-ylchromene-3-carboxamide
CID 3786468
N-(2,5-dimethoxyphenyl)-6-methyl-2-oxochromene-3-carboxamide
CID 100794447
6-methoxy-2-oxo-N-pentan-2-ylchromene-3-carboxamide
CID 133184087
6-chloro-N-(2,5-dimethoxyphenyl)-2-oxochromene-3-carboxamide
CID 7223522
6-methoxy-N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-oxochromene-3-carboxamide
CID 19207124
N-(2,4-dinitrophenyl)-6-methoxy-2-oxochromene-3-carboxamide
CID 21205557
6-methoxy-N-(4-methyl-1,3-thiazol-2-yl)-2-oxochromene-3-carboxamide
CID 4913043

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2-oxo-N-(2-propan-2-ylphenyl)chromene-3-carboxamide?
The IUPAC name of 6-methoxy-2-oxo-N-(2-propan-2-ylphenyl)chromene-3-carboxamide (CID 19207085) is 6-methoxy-2-oxo-N-(2-propan-2-ylphenyl)chromene-3-carboxamide.
What is the SMILES notation for 6-methoxy-2-oxo-N-(2-propan-2-ylphenyl)chromene-3-carboxamide?
The canonical SMILES for 6-methoxy-2-oxo-N-(2-propan-2-ylphenyl)chromene-3-carboxamide is COc1ccc2oc(=O)c(C(=O)Nc3ccccc3C(C)C)cc2c1.
What is the InChIKey of 6-methoxy-2-oxo-N-(2-propan-2-ylphenyl)chromene-3-carboxamide?
The InChIKey is BXENASPLDXPGEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19NO4/c1-12(2)15-6-4-5-7-17(15)21-19(22)16-11-13-10-14(24-3)8-9-18(13)25-20(16)23/h4-12H,1-3H3,(H,21,22).
What are the key properties of 6-methoxy-2-oxo-N-(2-propan-2-ylphenyl)chromene-3-carboxamide?
6-methoxy-2-oxo-N-(2-propan-2-ylphenyl)chromene-3-carboxamide has a molecular weight of 337.38 g/mol, XLogP of 4.18, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2-oxo-N-(2-propan-2-ylphenyl)chromene-3-carboxamide is sourced from PubChem (CID 19207085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).