2-(4-carbamoylphenyl)imino-N-(4-methoxyphenyl)chromene-3-carboxamide

C24H19N3O4 — CID 51368024

IUPAC2-(4-carbamoylphenyl)imino-N-(4-methoxyphenyl)chromene-3-carboxamide
SMILESCOc1ccc(NC(=O)c2cc3ccccc3o/c2=N\c2ccc(C(N)=O)cc2)cc1
InChIInChI=1S/C24H19N3O4/c1-30-19-12-10-17(11-13-19)26-23(29)20-14-16-4-2-3-5-21(16)31-24(20)27-18-8-6-15(7-9-18)22(25)28/h2-14H,1H3,(H2,25,28)(H,26,29)/b27-24-
InChIKeyHKFQISUBSQZOOS-PNHLSOANSA-N
MW413.43 g/mol
LogP4.03
Rot. Bonds5

About 2-(4-carbamoylphenyl)imino-N-(4-methoxyphenyl)chromene-3-carboxamide

2-(4-carbamoylphenyl)imino-N-(4-methoxyphenyl)chromene-3-carboxamide (PubChem CID 51368024) has the molecular formula C24H19N3O4 and a molecular weight of 413.43 g/mol. Its IUPAC name is 2-(4-carbamoylphenyl)imino-N-(4-methoxyphenyl)chromene-3-carboxamide.

Molecular Properties

Compound Name2-(4-carbamoylphenyl)imino-N-(4-methoxyphenyl)chromene-3-carboxamide
PubChem CID51368024
Molecular FormulaC24H19N3O4
Molecular Weight413.43 g/mol
Exact Mass413.14
IUPAC Name2-(4-carbamoylphenyl)imino-N-(4-methoxyphenyl)chromene-3-carboxamide
SMILESCOc1ccc(NC(=O)c2cc3ccccc3o/c2=N\c2ccc(C(N)=O)cc2)cc1
InChIInChI=1S/C24H19N3O4/c1-30-19-12-10-17(11-13-19)26-23(29)20-14-16-4-2-3-5-21(16)31-24(20)27-18-8-6-15(7-9-18)22(25)28/h2-14H,1H3,(H2,25,28)(H,26,29)/b27-24-
InChIKeyHKFQISUBSQZOOS-PNHLSOANSA-N
XLogP4.03
TPSA106.92 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500413.43
LogP ≤ 54.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(3-chloro-4-methylphenyl)imino-N-(4-methoxyphenyl)chromene-3-carboxamide
CID 51368049
2-(3-fluoro-4-methoxyphenyl)imino-N-(4-methoxyphenyl)chromene-3-carboxamide
CID 51368055
N-(3-methoxyphenyl)-2-(4-methylphenyl)iminochromene-3-carboxamide
CID 3963313
2-(4-methoxyphenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide
CID 51370455
2-(2,3-dimethylphenyl)imino-N-(4-methoxyphenyl)chromene-3-carboxamide
CID 986292
2-(3-chloro-4-methoxyphenyl)imino-N-(4-chlorophenyl)chromene-3-carboxamide
CID 51367328
N-(4-carbamoylphenyl)-2-oxochromene-3-carboxamide
CID 717683
2-[(4-methoxybenzoyl)hydrazinylidene]chromene-3-carboxamide
CID 3459938
4-[[3-[(3-chloro-4-fluorophenyl)carbamoyl]-6-methoxychromen-2-ylidene]amino]benzoate
CID 4072902
4-[[7-methoxy-3-[[3-(trifluoromethyl)phenyl]carbamoyl]chromen-2-ylidene]amino]benzoic acid
CID 4078376
2-(3,5-difluorophenyl)imino-N-phenylchromene-3-carboxamide
CID 51367987
N-(4-chlorophenyl)-2-(3,4-dimethylphenyl)iminochromene-3-carboxamide
CID 51367283

Frequently Asked Questions

What is the IUPAC name of 2-(4-carbamoylphenyl)imino-N-(4-methoxyphenyl)chromene-3-carboxamide?
The IUPAC name of 2-(4-carbamoylphenyl)imino-N-(4-methoxyphenyl)chromene-3-carboxamide (CID 51368024) is 2-(4-carbamoylphenyl)imino-N-(4-methoxyphenyl)chromene-3-carboxamide.
What is the SMILES notation for 2-(4-carbamoylphenyl)imino-N-(4-methoxyphenyl)chromene-3-carboxamide?
The canonical SMILES for 2-(4-carbamoylphenyl)imino-N-(4-methoxyphenyl)chromene-3-carboxamide is COc1ccc(NC(=O)c2cc3ccccc3o/c2=N\c2ccc(C(N)=O)cc2)cc1.
What is the InChIKey of 2-(4-carbamoylphenyl)imino-N-(4-methoxyphenyl)chromene-3-carboxamide?
The InChIKey is HKFQISUBSQZOOS-PNHLSOANSA-N. The full InChI is InChI=1S/C24H19N3O4/c1-30-19-12-10-17(11-13-19)26-23(29)20-14-16-4-2-3-5-21(16)31-24(20)27-18-8-6-15(7-9-18)22(25)28/h2-14H,1H3,(H2,25,28)(H,26,29)/b27-24-.
What are the key properties of 2-(4-carbamoylphenyl)imino-N-(4-methoxyphenyl)chromene-3-carboxamide?
2-(4-carbamoylphenyl)imino-N-(4-methoxyphenyl)chromene-3-carboxamide has a molecular weight of 413.43 g/mol, XLogP of 4.03, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-carbamoylphenyl)imino-N-(4-methoxyphenyl)chromene-3-carboxamide is sourced from PubChem (CID 51368024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).