N-(4-methyl-2-oxochromen-7-yl)-2-naphthalen-2-ylacetamide

C22H17NO3 — CID 26878478

IUPACN-(4-methyl-2-oxochromen-7-yl)-2-naphthalen-2-ylacetamide
SMILESCc1cc(=O)oc2cc(NC(=O)Cc3ccc4ccccc4c3)ccc12
InChIInChI=1S/C22H17NO3/c1-14-10-22(25)26-20-13-18(8-9-19(14)20)23-21(24)12-15-6-7-16-4-2-3-5-17(16)11-15/h2-11,13H,12H2,1H3,(H,23,24)
InChIKeyVODYPQOWOGGHAV-UHFFFAOYSA-N
MW343.38 g/mol
LogP4.44
Rot. Bonds3

About N-(4-methyl-2-oxochromen-7-yl)-2-naphthalen-2-ylacetamide

N-(4-methyl-2-oxochromen-7-yl)-2-naphthalen-2-ylacetamide (PubChem CID 26878478) has the molecular formula C22H17NO3 and a molecular weight of 343.38 g/mol. Its IUPAC name is N-(4-methyl-2-oxochromen-7-yl)-2-naphthalen-2-ylacetamide.

Molecular Properties

Compound NameN-(4-methyl-2-oxochromen-7-yl)-2-naphthalen-2-ylacetamide
PubChem CID26878478
Molecular FormulaC22H17NO3
Molecular Weight343.38 g/mol
Exact Mass343.12
IUPAC NameN-(4-methyl-2-oxochromen-7-yl)-2-naphthalen-2-ylacetamide
SMILESCc1cc(=O)oc2cc(NC(=O)Cc3ccc4ccccc4c3)ccc12
InChIInChI=1S/C22H17NO3/c1-14-10-22(25)26-20-13-18(8-9-19(14)20)23-21(24)12-15-6-7-16-4-2-3-5-17(16)11-15/h2-11,13H,12H2,1H3,(H,23,24)
InChIKeyVODYPQOWOGGHAV-UHFFFAOYSA-N
XLogP4.44
TPSA59.31 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.38
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(3,4-dimethoxyphenyl)-N-(4-methyl-2-oxochromen-7-yl)acetamide
CID 2166757
2-amino-N-(4-methyl-2-oxochromen-7-yl)acetamide
CID 688482
N-(4-methyl-2-oxochromen-7-yl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide
CID 171911797
2-(1,3-dioxoisoindol-2-yl)-N-(4-methyl-2-oxochromen-7-yl)acetamide
CID 19166972
2-methyl-N-[4-[3-[(4-methyl-2-oxochromen-7-yl)amino]-3-oxopropyl]phenyl]propanamide
CID 134132292
N-(4-methylphenyl)-2-naphthalen-2-ylacetamide
CID 9411639
2-(6-methyl-1-benzofuran-3-yl)-N-(4-methyl-2-oxochromen-7-yl)acetamide
CID 17456098
N-(4-acetamidophenyl)-2-naphthalen-2-ylacetamide
CID 26499620
N-(4-methyl-3-nitrophenyl)-2-naphthalen-2-ylacetamide
CID 26575746
N'-hydroxy-N-(4-methyl-2-oxochromen-7-yl)octanediamide
CID 53393956
N-[3,5-bis[(2-naphthalen-2-ylacetyl)amino]phenyl]-2-naphthalen-2-ylacetamide
CID 67257199
N-(4-methyl-2-oxochromen-7-yl)-3-(2-oxo-1-pyridinyl)propanamide
CID 172659008

Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-2-oxochromen-7-yl)-2-naphthalen-2-ylacetamide?
The IUPAC name of N-(4-methyl-2-oxochromen-7-yl)-2-naphthalen-2-ylacetamide (CID 26878478) is N-(4-methyl-2-oxochromen-7-yl)-2-naphthalen-2-ylacetamide.
What is the SMILES notation for N-(4-methyl-2-oxochromen-7-yl)-2-naphthalen-2-ylacetamide?
The canonical SMILES for N-(4-methyl-2-oxochromen-7-yl)-2-naphthalen-2-ylacetamide is Cc1cc(=O)oc2cc(NC(=O)Cc3ccc4ccccc4c3)ccc12.
What is the InChIKey of N-(4-methyl-2-oxochromen-7-yl)-2-naphthalen-2-ylacetamide?
The InChIKey is VODYPQOWOGGHAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17NO3/c1-14-10-22(25)26-20-13-18(8-9-19(14)20)23-21(24)12-15-6-7-16-4-2-3-5-17(16)11-15/h2-11,13H,12H2,1H3,(H,23,24).
What are the key properties of N-(4-methyl-2-oxochromen-7-yl)-2-naphthalen-2-ylacetamide?
N-(4-methyl-2-oxochromen-7-yl)-2-naphthalen-2-ylacetamide has a molecular weight of 343.38 g/mol, XLogP of 4.44, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-2-oxochromen-7-yl)-2-naphthalen-2-ylacetamide is sourced from PubChem (CID 26878478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).