N-(2,4-dimethoxyphenyl)-2-(4-oxochromen-2-yl)acetamide

C19H17NO5 — CID 10735810

IUPACN-(2,4-dimethoxyphenyl)-2-(4-oxochromen-2-yl)acetamide
SMILESCOc1ccc(NC(=O)Cc2cc(=O)c3ccccc3o2)c(OC)c1
InChIInChI=1S/C19H17NO5/c1-23-12-7-8-15(18(10-12)24-2)20-19(22)11-13-9-16(21)14-5-3-4-6-17(14)25-13/h3-10H,11H2,1-2H3,(H,20,22)
InChIKeyXSEKMJZKVUEOSA-UHFFFAOYSA-N
MW339.35 g/mol
LogP2.99
Rot. Bonds5

About N-(2,4-dimethoxyphenyl)-2-(4-oxochromen-2-yl)acetamide

N-(2,4-dimethoxyphenyl)-2-(4-oxochromen-2-yl)acetamide (PubChem CID 10735810) has the molecular formula C19H17NO5 and a molecular weight of 339.35 g/mol. Its IUPAC name is N-(2,4-dimethoxyphenyl)-2-(4-oxochromen-2-yl)acetamide.

Molecular Properties

Compound NameN-(2,4-dimethoxyphenyl)-2-(4-oxochromen-2-yl)acetamide
PubChem CID10735810
Molecular FormulaC19H17NO5
Molecular Weight339.35 g/mol
Exact Mass339.11
IUPAC NameN-(2,4-dimethoxyphenyl)-2-(4-oxochromen-2-yl)acetamide
SMILESCOc1ccc(NC(=O)Cc2cc(=O)c3ccccc3o2)c(OC)c1
InChIInChI=1S/C19H17NO5/c1-23-12-7-8-15(18(10-12)24-2)20-19(22)11-13-9-16(21)14-5-3-4-6-17(14)25-13/h3-10H,11H2,1-2H3,(H,20,22)
InChIKeyXSEKMJZKVUEOSA-UHFFFAOYSA-N
XLogP2.99
TPSA77.77 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.35
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2,4-dimethoxyphenyl)-2-methyl-1-benzofuran-3-carboxamide
CID 110703181
N-(2,4-dimethoxyphenyl)-2-(7-methoxy-4-methyl-2-oxochromen-3-yl)acetamide
CID 4893034
N-(2,4-dimethoxyphenyl)-2-(4-methoxyphenoxy)acetamide
CID 868059
N-(2,4-dimethoxyphenyl)-2-(2,4-dimethyl-1,3-oxazol-5-yl)acetamide
CID 110680145
N-(2,4-dimethoxyphenyl)-3-(3-phenylpropanoylamino)-1-benzofuran-2-carboxamide
CID 16814944
2-(2,4-dimethoxyphenyl)-N-naphthalen-1-ylacetamide
CID 16913160
N-(2,4-dimethoxyphenyl)-3-[[2-(3-methylphenoxy)acetyl]amino]-1-benzofuran-2-carboxamide
CID 20875443
3-[(2-cyclopentylacetyl)amino]-N-(2,4-dimethoxyphenyl)-1-benzofuran-2-carboxamide
CID 7160217
3-[2-(2,4-dimethoxyanilino)-2-oxoethyl]-1-methylindole-2-carboxylic acid
CID 4661483
N-(2,4-dimethoxyphenyl)-1-oxoisochromene-3-carboxamide
CID 99797944
1-(1,2-benzoxazol-3-ylmethyl)-3-(2,4-dimethoxyphenyl)urea
CID 20901312
2-(5-chloro-2-methoxyphenyl)-N-(2,4-dimethoxyphenyl)acetamide
CID 17423898

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethoxyphenyl)-2-(4-oxochromen-2-yl)acetamide?
The IUPAC name of N-(2,4-dimethoxyphenyl)-2-(4-oxochromen-2-yl)acetamide (CID 10735810) is N-(2,4-dimethoxyphenyl)-2-(4-oxochromen-2-yl)acetamide.
What is the SMILES notation for N-(2,4-dimethoxyphenyl)-2-(4-oxochromen-2-yl)acetamide?
The canonical SMILES for N-(2,4-dimethoxyphenyl)-2-(4-oxochromen-2-yl)acetamide is COc1ccc(NC(=O)Cc2cc(=O)c3ccccc3o2)c(OC)c1.
What is the InChIKey of N-(2,4-dimethoxyphenyl)-2-(4-oxochromen-2-yl)acetamide?
The InChIKey is XSEKMJZKVUEOSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17NO5/c1-23-12-7-8-15(18(10-12)24-2)20-19(22)11-13-9-16(21)14-5-3-4-6-17(14)25-13/h3-10H,11H2,1-2H3,(H,20,22).
What are the key properties of N-(2,4-dimethoxyphenyl)-2-(4-oxochromen-2-yl)acetamide?
N-(2,4-dimethoxyphenyl)-2-(4-oxochromen-2-yl)acetamide has a molecular weight of 339.35 g/mol, XLogP of 2.99, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethoxyphenyl)-2-(4-oxochromen-2-yl)acetamide is sourced from PubChem (CID 10735810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).