N-(2-anilino-2-oxo-1-phenylethyl)-2H-chromene-3-carboxamide

C24H20N2O3 — CID 55779225

IUPACN-(2-anilino-2-oxo-1-phenylethyl)-2H-chromene-3-carboxamide
SMILESO=C(NC(C(=O)Nc1ccccc1)c1ccccc1)C1=Cc2ccccc2OC1
InChIInChI=1S/C24H20N2O3/c27-23(19-15-18-11-7-8-14-21(18)29-16-19)26-22(17-9-3-1-4-10-17)24(28)25-20-12-5-2-6-13-20/h1-15,22H,16H2,(H,25,28)(H,26,27)
InChIKeyITDGGJNZMJPTGV-UHFFFAOYSA-N
MW384.44 g/mol
LogP3.96
Rot. Bonds5

About N-(2-anilino-2-oxo-1-phenylethyl)-2H-chromene-3-carboxamide

N-(2-anilino-2-oxo-1-phenylethyl)-2H-chromene-3-carboxamide (PubChem CID 55779225) has the molecular formula C24H20N2O3 and a molecular weight of 384.44 g/mol. Its IUPAC name is N-(2-anilino-2-oxo-1-phenylethyl)-2H-chromene-3-carboxamide.

Molecular Properties

Compound NameN-(2-anilino-2-oxo-1-phenylethyl)-2H-chromene-3-carboxamide
PubChem CID55779225
Molecular FormulaC24H20N2O3
Molecular Weight384.44 g/mol
Exact Mass384.15
IUPAC NameN-(2-anilino-2-oxo-1-phenylethyl)-2H-chromene-3-carboxamide
SMILESO=C(NC(C(=O)Nc1ccccc1)c1ccccc1)C1=Cc2ccccc2OC1
InChIInChI=1S/C24H20N2O3/c27-23(19-15-18-11-7-8-14-21(18)29-16-19)26-22(17-9-3-1-4-10-17)24(28)25-20-12-5-2-6-13-20/h1-15,22H,16H2,(H,25,28)(H,26,27)
InChIKeyITDGGJNZMJPTGV-UHFFFAOYSA-N
XLogP3.96
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.44
LogP ≤ 53.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(2-methylpropanoylamino)phenyl]-2H-chromene-3-carboxamide
CID 26782775
N-[(1R)-2-amino-1-(4-chlorophenyl)-2-oxoethyl]-2H-chromene-3-carboxamide
CID 95981582
3-(2H-chromene-3-carbonylamino)butanoic acid
CID 119220849
2-(2H-chromene-3-carbonylamino)-2-cyclopropylacetic acid
CID 119213336
N-(4-acetylphenyl)-2H-chromene-3-carboxamide
CID 9042646
N-(3-methylphenyl)-2H-chromene-3-carboxamide
CID 7464936
methyl 2-(2H-chromene-3-carbonylamino)-3-methylbutanoate
CID 75856990
[(2S)-1-oxo-1-(4-propan-2-ylanilino)propan-2-yl] 2H-chromene-3-carboxylate
CID 8744452
(2R)-3-(2H-chromene-3-carbonylamino)-2-methylpropanoic acid
CID 124689247
N-(3,4-difluorophenyl)-2H-chromene-3-carboxamide
CID 26736929
N-(2-anilino-2-oxo-1-phenylethyl)-4-ethylbenzamide
CID 55726687
4-fluoro-N-[(1S)-2-[4-(hydroxyamino)anilino]-2-oxo-1-phenylethyl]benzamide
CID 72705119

Frequently Asked Questions

What is the IUPAC name of N-(2-anilino-2-oxo-1-phenylethyl)-2H-chromene-3-carboxamide?
The IUPAC name of N-(2-anilino-2-oxo-1-phenylethyl)-2H-chromene-3-carboxamide (CID 55779225) is N-(2-anilino-2-oxo-1-phenylethyl)-2H-chromene-3-carboxamide.
What is the SMILES notation for N-(2-anilino-2-oxo-1-phenylethyl)-2H-chromene-3-carboxamide?
The canonical SMILES for N-(2-anilino-2-oxo-1-phenylethyl)-2H-chromene-3-carboxamide is O=C(NC(C(=O)Nc1ccccc1)c1ccccc1)C1=Cc2ccccc2OC1.
What is the InChIKey of N-(2-anilino-2-oxo-1-phenylethyl)-2H-chromene-3-carboxamide?
The InChIKey is ITDGGJNZMJPTGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20N2O3/c27-23(19-15-18-11-7-8-14-21(18)29-16-19)26-22(17-9-3-1-4-10-17)24(28)25-20-12-5-2-6-13-20/h1-15,22H,16H2,(H,25,28)(H,26,27).
What are the key properties of N-(2-anilino-2-oxo-1-phenylethyl)-2H-chromene-3-carboxamide?
N-(2-anilino-2-oxo-1-phenylethyl)-2H-chromene-3-carboxamide has a molecular weight of 384.44 g/mol, XLogP of 3.96, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-anilino-2-oxo-1-phenylethyl)-2H-chromene-3-carboxamide is sourced from PubChem (CID 55779225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).