N-methyl-2-phenyliminochromene-3-carboxamide

C17H14N2O2 — CID 826595

IUPACN-methyl-2-phenyliminochromene-3-carboxamide
SMILESCNC(=O)c1cc2ccccc2o/c1=N\c1ccccc1
InChIInChI=1S/C17H14N2O2/c1-18-16(20)14-11-12-7-5-6-10-15(12)21-17(14)19-13-8-3-2-4-9-13/h2-11H,1H3,(H,18,20)/b19-17-
InChIKeyBDJZYAABUGLDCQ-ZPHPHTNESA-N
MW278.31 g/mol
LogP3.02
Rot. Bonds2

About N-methyl-2-phenyliminochromene-3-carboxamide

N-methyl-2-phenyliminochromene-3-carboxamide (PubChem CID 826595) has the molecular formula C17H14N2O2 and a molecular weight of 278.31 g/mol. Its IUPAC name is N-methyl-2-phenyliminochromene-3-carboxamide.

Molecular Properties

Compound NameN-methyl-2-phenyliminochromene-3-carboxamide
PubChem CID826595
Molecular FormulaC17H14N2O2
Molecular Weight278.31 g/mol
Exact Mass278.11
IUPAC NameN-methyl-2-phenyliminochromene-3-carboxamide
SMILESCNC(=O)c1cc2ccccc2o/c1=N\c1ccccc1
InChIInChI=1S/C17H14N2O2/c1-18-16(20)14-11-12-7-5-6-10-15(12)21-17(14)19-13-8-3-2-4-9-13/h2-11H,1H3,(H,18,20)/b19-17-
InChIKeyBDJZYAABUGLDCQ-ZPHPHTNESA-N
XLogP3.02
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.31
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3,5-difluorophenyl)imino-N-phenylchromene-3-carboxamide
CID 51367987
N-acetyl-2-(3-nitrophenyl)iminochromene-3-carboxamide
CID 3551881
2-(3-ethylphenyl)imino-N-(furan-2-ylmethyl)chromene-3-carboxamide
CID 51367519
2-(3-methylphenyl)imino-N-pyridin-2-ylchromene-3-carboxamide
CID 51367703
N-(2-methylphenyl)-2-(4-propan-2-ylphenyl)iminochromene-3-carboxamide
CID 51367871
2-(4-fluorophenyl)imino-N-(furan-2-ylmethyl)chromene-3-carboxamide
CID 51367538
2-(3-chlorophenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide
CID 51367843
2-(4-methylphenyl)imino-N-(1,3-thiazol-2-yl)chromene-3-carboxamide
CID 5085744
ethyl 4-[[3-(acetylcarbamoyl)chromen-2-ylidene]amino]benzoate
CID 35207170
2-(4-methoxyphenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide
CID 51370455
2-(4-carbamoylphenyl)imino-N-(4-methoxyphenyl)chromene-3-carboxamide
CID 51368024
2-(3-fluorophenyl)imino-N-(furan-2-ylmethyl)chromene-3-carboxamide
CID 51367537

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-phenyliminochromene-3-carboxamide?
The IUPAC name of N-methyl-2-phenyliminochromene-3-carboxamide (CID 826595) is N-methyl-2-phenyliminochromene-3-carboxamide.
What is the SMILES notation for N-methyl-2-phenyliminochromene-3-carboxamide?
The canonical SMILES for N-methyl-2-phenyliminochromene-3-carboxamide is CNC(=O)c1cc2ccccc2o/c1=N\c1ccccc1.
What is the InChIKey of N-methyl-2-phenyliminochromene-3-carboxamide?
The InChIKey is BDJZYAABUGLDCQ-ZPHPHTNESA-N. The full InChI is InChI=1S/C17H14N2O2/c1-18-16(20)14-11-12-7-5-6-10-15(12)21-17(14)19-13-8-3-2-4-9-13/h2-11H,1H3,(H,18,20)/b19-17-.
What are the key properties of N-methyl-2-phenyliminochromene-3-carboxamide?
N-methyl-2-phenyliminochromene-3-carboxamide has a molecular weight of 278.31 g/mol, XLogP of 3.02, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-phenyliminochromene-3-carboxamide is sourced from PubChem (CID 826595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).