2-(3-ethyl-2,4-dioxoquinazolin-1-yl)-N-(furan-2-ylmethyl)-N-phenylacetamide

C23H21N3O4 — CID 55447584

IUPAC2-(3-ethyl-2,4-dioxoquinazolin-1-yl)-N-(furan-2-ylmethyl)-N-phenylacetamide
SMILESCCn1c(=O)c2ccccc2n(CC(=O)N(Cc2ccco2)c2ccccc2)c1=O
InChIInChI=1S/C23H21N3O4/c1-2-24-22(28)19-12-6-7-13-20(19)26(23(24)29)16-21(27)25(15-18-11-8-14-30-18)17-9-4-3-5-10-17/h3-14H,2,15-16H2,1H3
InChIKeyCVVNLXRCKGWXSS-UHFFFAOYSA-N
MW403.44 g/mol
LogP3.01
Rot. Bonds6

About 2-(3-ethyl-2,4-dioxoquinazolin-1-yl)-N-(furan-2-ylmethyl)-N-phenylacetamide

2-(3-ethyl-2,4-dioxoquinazolin-1-yl)-N-(furan-2-ylmethyl)-N-phenylacetamide (PubChem CID 55447584) has the molecular formula C23H21N3O4 and a molecular weight of 403.44 g/mol. Its IUPAC name is 2-(3-ethyl-2,4-dioxoquinazolin-1-yl)-N-(furan-2-ylmethyl)-N-phenylacetamide.

Molecular Properties

Compound Name2-(3-ethyl-2,4-dioxoquinazolin-1-yl)-N-(furan-2-ylmethyl)-N-phenylacetamide
PubChem CID55447584
Molecular FormulaC23H21N3O4
Molecular Weight403.44 g/mol
Exact Mass403.15
IUPAC Name2-(3-ethyl-2,4-dioxoquinazolin-1-yl)-N-(furan-2-ylmethyl)-N-phenylacetamide
SMILESCCn1c(=O)c2ccccc2n(CC(=O)N(Cc2ccco2)c2ccccc2)c1=O
InChIInChI=1S/C23H21N3O4/c1-2-24-22(28)19-12-6-7-13-20(19)26(23(24)29)16-21(27)25(15-18-11-8-14-30-18)17-9-4-3-5-10-17/h3-14H,2,15-16H2,1H3
InChIKeyCVVNLXRCKGWXSS-UHFFFAOYSA-N
XLogP3.01
TPSA77.45 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.44
LogP ≤ 53.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

N-[4-(dimethylamino)phenyl]-2-[3-(furan-2-ylmethyl)-2,4-dioxoquinazolin-1-yl]acetamide
CID 51363024
ethyl 2-(3-ethyl-2,4-dioxoquinazolin-1-yl)acetate
CID 47149271
5-[1-[2-(dipropylamino)-2-oxoethyl]-2,4-dioxoquinazolin-3-yl]-N-(furan-2-ylmethyl)pentanamide
CID 3236263
2-(3-ethyl-2,4-dioxoquinazolin-1-yl)-N-methyl-N-[(1R)-1-thiophen-2-ylethyl]acetamide
CID 31683892
2-[2,4-dioxo-3-(2-phenylethyl)quinazolin-1-yl]-N-(furan-2-ylmethyl)acetamide
CID 22429523
2-[3-[2-(furan-2-ylmethylamino)-2-oxoethyl]-2,4-dioxoquinazolin-1-yl]-N-phenylacetamide
CID 22429989
N-(furan-2-ylmethyl)-3-methyl-4-oxo-N-phenylphthalazine-1-carboxamide
CID 18100582
N-[(1,3-diphenylpyrazol-4-yl)methyl]-2-(3-ethyl-2,4-dioxoquinazolin-1-yl)-N-methylacetamide
CID 31801441
2-[3-(furan-2-ylmethyl)-2,4-dioxoquinazolin-1-yl]-N-[(4-methoxyphenyl)methyl]acetamide
CID 6502140
N-(furan-2-ylmethyl)-2-[4-(1-hydroxyethyl)piperidin-1-yl]-N-phenylacetamide
CID 111113787
4-[[[2-(3-ethyl-2,4-dioxoquinazolin-1-yl)acetyl]-methylamino]methyl]-N-methylbenzamide
CID 38745501
N-(4-chlorophenyl)-2-[3-(furan-2-ylmethyl)-2,4-dioxoquinazolin-1-yl]acetamide
CID 22429609

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethyl-2,4-dioxoquinazolin-1-yl)-N-(furan-2-ylmethyl)-N-phenylacetamide?
The IUPAC name of 2-(3-ethyl-2,4-dioxoquinazolin-1-yl)-N-(furan-2-ylmethyl)-N-phenylacetamide (CID 55447584) is 2-(3-ethyl-2,4-dioxoquinazolin-1-yl)-N-(furan-2-ylmethyl)-N-phenylacetamide.
What is the SMILES notation for 2-(3-ethyl-2,4-dioxoquinazolin-1-yl)-N-(furan-2-ylmethyl)-N-phenylacetamide?
The canonical SMILES for 2-(3-ethyl-2,4-dioxoquinazolin-1-yl)-N-(furan-2-ylmethyl)-N-phenylacetamide is CCn1c(=O)c2ccccc2n(CC(=O)N(Cc2ccco2)c2ccccc2)c1=O.
What is the InChIKey of 2-(3-ethyl-2,4-dioxoquinazolin-1-yl)-N-(furan-2-ylmethyl)-N-phenylacetamide?
The InChIKey is CVVNLXRCKGWXSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N3O4/c1-2-24-22(28)19-12-6-7-13-20(19)26(23(24)29)16-21(27)25(15-18-11-8-14-30-18)17-9-4-3-5-10-17/h3-14H,2,15-16H2,1H3.
What are the key properties of 2-(3-ethyl-2,4-dioxoquinazolin-1-yl)-N-(furan-2-ylmethyl)-N-phenylacetamide?
2-(3-ethyl-2,4-dioxoquinazolin-1-yl)-N-(furan-2-ylmethyl)-N-phenylacetamide has a molecular weight of 403.44 g/mol, XLogP of 3.01, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethyl-2,4-dioxoquinazolin-1-yl)-N-(furan-2-ylmethyl)-N-phenylacetamide is sourced from PubChem (CID 55447584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).