N-(2-cyclobutyl-4-oxoquinazolin-3-yl)pyridine-3-carboxamide

C18H16N4O2 — CID 43816389

IUPACN-(2-cyclobutyl-4-oxoquinazolin-3-yl)pyridine-3-carboxamide
SMILESO=C(Nn1c(C2CCC2)nc2ccccc2c1=O)c1cccnc1
InChIInChI=1S/C18H16N4O2/c23-17(13-7-4-10-19-11-13)21-22-16(12-5-3-6-12)20-15-9-2-1-8-14(15)18(22)24/h1-2,4,7-12H,3,5-6H2,(H,21,23)
InChIKeyFLDICUORPAQVFX-UHFFFAOYSA-N
MW320.35 g/mol
LogP2.44
Rot. Bonds3

About N-(2-cyclobutyl-4-oxoquinazolin-3-yl)pyridine-3-carboxamide

N-(2-cyclobutyl-4-oxoquinazolin-3-yl)pyridine-3-carboxamide (PubChem CID 43816389) has the molecular formula C18H16N4O2 and a molecular weight of 320.35 g/mol. Its IUPAC name is N-(2-cyclobutyl-4-oxoquinazolin-3-yl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-cyclobutyl-4-oxoquinazolin-3-yl)pyridine-3-carboxamide
PubChem CID43816389
Molecular FormulaC18H16N4O2
Molecular Weight320.35 g/mol
Exact Mass320.13
IUPAC NameN-(2-cyclobutyl-4-oxoquinazolin-3-yl)pyridine-3-carboxamide
SMILESO=C(Nn1c(C2CCC2)nc2ccccc2c1=O)c1cccnc1
InChIInChI=1S/C18H16N4O2/c23-17(13-7-4-10-19-11-13)21-22-16(12-5-3-6-12)20-15-9-2-1-8-14(15)18(22)24/h1-2,4,7-12H,3,5-6H2,(H,21,23)
InChIKeyFLDICUORPAQVFX-UHFFFAOYSA-N
XLogP2.44
TPSA76.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.35
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(2-cyclobutyl-4-oxoquinazolin-3-yl)pyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclobutyl-4-oxoquinazolin-3-yl)pyridine-3-carboxamide?
The IUPAC name of N-(2-cyclobutyl-4-oxoquinazolin-3-yl)pyridine-3-carboxamide (CID 43816389) is N-(2-cyclobutyl-4-oxoquinazolin-3-yl)pyridine-3-carboxamide.
What is the SMILES notation for N-(2-cyclobutyl-4-oxoquinazolin-3-yl)pyridine-3-carboxamide?
The canonical SMILES for N-(2-cyclobutyl-4-oxoquinazolin-3-yl)pyridine-3-carboxamide is O=C(Nn1c(C2CCC2)nc2ccccc2c1=O)c1cccnc1.
What is the InChIKey of N-(2-cyclobutyl-4-oxoquinazolin-3-yl)pyridine-3-carboxamide?
The InChIKey is FLDICUORPAQVFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N4O2/c23-17(13-7-4-10-19-11-13)21-22-16(12-5-3-6-12)20-15-9-2-1-8-14(15)18(22)24/h1-2,4,7-12H,3,5-6H2,(H,21,23).
What are the key properties of N-(2-cyclobutyl-4-oxoquinazolin-3-yl)pyridine-3-carboxamide?
N-(2-cyclobutyl-4-oxoquinazolin-3-yl)pyridine-3-carboxamide has a molecular weight of 320.35 g/mol, XLogP of 2.44, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclobutyl-4-oxoquinazolin-3-yl)pyridine-3-carboxamide is sourced from PubChem (CID 43816389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).