N-(4-oxochromen-2-yl)-2-phenylpropanamide

C18H15NO3 — CID 3041756

IUPACN-(4-oxochromen-2-yl)-2-phenylpropanamide
SMILESCC(C(=O)Nc1cc(=O)c2ccccc2o1)c1ccccc1
InChIInChI=1S/C18H15NO3/c1-12(13-7-3-2-4-8-13)18(21)19-17-11-15(20)14-9-5-6-10-16(14)22-17/h2-12H,1H3,(H,19,21)
InChIKeyUTHSHZYFNYKPTB-UHFFFAOYSA-N
MW293.32 g/mol
LogP3.54
Rot. Bonds3

About N-(4-oxochromen-2-yl)-2-phenylpropanamide

N-(4-oxochromen-2-yl)-2-phenylpropanamide (PubChem CID 3041756) has the molecular formula C18H15NO3 and a molecular weight of 293.32 g/mol. Its IUPAC name is N-(4-oxochromen-2-yl)-2-phenylpropanamide.

Molecular Properties

Compound NameN-(4-oxochromen-2-yl)-2-phenylpropanamide
PubChem CID3041756
Molecular FormulaC18H15NO3
Molecular Weight293.32 g/mol
Exact Mass293.11
IUPAC NameN-(4-oxochromen-2-yl)-2-phenylpropanamide
SMILESCC(C(=O)Nc1cc(=O)c2ccccc2o1)c1ccccc1
InChIInChI=1S/C18H15NO3/c1-12(13-7-3-2-4-8-13)18(21)19-17-11-15(20)14-9-5-6-10-16(14)22-17/h2-12H,1H3,(H,19,21)
InChIKeyUTHSHZYFNYKPTB-UHFFFAOYSA-N
XLogP3.54
TPSA59.31 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.32
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-oxochromen-2-yl)-2-phenylpropanamide?
The IUPAC name of N-(4-oxochromen-2-yl)-2-phenylpropanamide (CID 3041756) is N-(4-oxochromen-2-yl)-2-phenylpropanamide.
What is the SMILES notation for N-(4-oxochromen-2-yl)-2-phenylpropanamide?
The canonical SMILES for N-(4-oxochromen-2-yl)-2-phenylpropanamide is CC(C(=O)Nc1cc(=O)c2ccccc2o1)c1ccccc1.
What is the InChIKey of N-(4-oxochromen-2-yl)-2-phenylpropanamide?
The InChIKey is UTHSHZYFNYKPTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15NO3/c1-12(13-7-3-2-4-8-13)18(21)19-17-11-15(20)14-9-5-6-10-16(14)22-17/h2-12H,1H3,(H,19,21).
What are the key properties of N-(4-oxochromen-2-yl)-2-phenylpropanamide?
N-(4-oxochromen-2-yl)-2-phenylpropanamide has a molecular weight of 293.32 g/mol, XLogP of 3.54, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-oxochromen-2-yl)-2-phenylpropanamide is sourced from PubChem (CID 3041756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).