N-(furan-2-ylmethyl)-2-(4-oxoquinazolin-3-yl)acetamide

C15H13N3O3 — CID 893670

IUPACN-(furan-2-ylmethyl)-2-(4-oxoquinazolin-3-yl)acetamide
SMILESO=C(Cn1cnc2ccccc2c1=O)NCc1ccco1
InChIInChI=1S/C15H13N3O3/c19-14(16-8-11-4-3-7-21-11)9-18-10-17-13-6-2-1-5-12(13)15(18)20/h1-7,10H,8-9H2,(H,16,19)
InChIKeyNOEGIXSQJCINOY-UHFFFAOYSA-N
MW283.29 g/mol
LogP1.31
Rot. Bonds4

About N-(furan-2-ylmethyl)-2-(4-oxoquinazolin-3-yl)acetamide

N-(furan-2-ylmethyl)-2-(4-oxoquinazolin-3-yl)acetamide (PubChem CID 893670) has the molecular formula C15H13N3O3 and a molecular weight of 283.29 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-2-(4-oxoquinazolin-3-yl)acetamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-2-(4-oxoquinazolin-3-yl)acetamide
PubChem CID893670
Molecular FormulaC15H13N3O3
Molecular Weight283.29 g/mol
Exact Mass283.10
IUPAC NameN-(furan-2-ylmethyl)-2-(4-oxoquinazolin-3-yl)acetamide
SMILESO=C(Cn1cnc2ccccc2c1=O)NCc1ccco1
InChIInChI=1S/C15H13N3O3/c19-14(16-8-11-4-3-7-21-11)9-18-10-17-13-6-2-1-5-12(13)15(18)20/h1-7,10H,8-9H2,(H,16,19)
InChIKeyNOEGIXSQJCINOY-UHFFFAOYSA-N
XLogP1.31
TPSA77.13 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.29
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-2-(4-oxoquinazolin-3-yl)acetamide?
The IUPAC name of N-(furan-2-ylmethyl)-2-(4-oxoquinazolin-3-yl)acetamide (CID 893670) is N-(furan-2-ylmethyl)-2-(4-oxoquinazolin-3-yl)acetamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-2-(4-oxoquinazolin-3-yl)acetamide?
The canonical SMILES for N-(furan-2-ylmethyl)-2-(4-oxoquinazolin-3-yl)acetamide is O=C(Cn1cnc2ccccc2c1=O)NCc1ccco1.
What is the InChIKey of N-(furan-2-ylmethyl)-2-(4-oxoquinazolin-3-yl)acetamide?
The InChIKey is NOEGIXSQJCINOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O3/c19-14(16-8-11-4-3-7-21-11)9-18-10-17-13-6-2-1-5-12(13)15(18)20/h1-7,10H,8-9H2,(H,16,19).
What are the key properties of N-(furan-2-ylmethyl)-2-(4-oxoquinazolin-3-yl)acetamide?
N-(furan-2-ylmethyl)-2-(4-oxoquinazolin-3-yl)acetamide has a molecular weight of 283.29 g/mol, XLogP of 1.31, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-2-(4-oxoquinazolin-3-yl)acetamide is sourced from PubChem (CID 893670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).