4-cyclobutyl-6-methyl-2-(3-pyrazol-1-ylazetidin-1-yl)pyrimidine

C15H19N5 — CID 56868221

IUPAC4-cyclobutyl-6-methyl-2-(3-pyrazol-1-ylazetidin-1-yl)pyrimidine
SMILESCc1cc(C2CCC2)nc(N2CC(n3cccn3)C2)n1
InChIInChI=1S/C15H19N5/c1-11-8-14(12-4-2-5-12)18-15(17-11)19-9-13(10-19)20-7-3-6-16-20/h3,6-8,12-13H,2,4-5,9-10H2,1H3
InChIKeyIJWYIITYHYGVRY-UHFFFAOYSA-N
MW269.35 g/mol
LogP2.31
Rot. Bonds3

About 4-cyclobutyl-6-methyl-2-(3-pyrazol-1-ylazetidin-1-yl)pyrimidine

4-cyclobutyl-6-methyl-2-(3-pyrazol-1-ylazetidin-1-yl)pyrimidine (PubChem CID 56868221) has the molecular formula C15H19N5 and a molecular weight of 269.35 g/mol. Its IUPAC name is 4-cyclobutyl-6-methyl-2-(3-pyrazol-1-ylazetidin-1-yl)pyrimidine.

Molecular Properties

Compound Name4-cyclobutyl-6-methyl-2-(3-pyrazol-1-ylazetidin-1-yl)pyrimidine
PubChem CID56868221
Molecular FormulaC15H19N5
Molecular Weight269.35 g/mol
Exact Mass269.16
IUPAC Name4-cyclobutyl-6-methyl-2-(3-pyrazol-1-ylazetidin-1-yl)pyrimidine
SMILESCc1cc(C2CCC2)nc(N2CC(n3cccn3)C2)n1
InChIInChI=1S/C15H19N5/c1-11-8-14(12-4-2-5-12)18-15(17-11)19-9-13(10-19)20-7-3-6-16-20/h3,6-8,12-13H,2,4-5,9-10H2,1H3
InChIKeyIJWYIITYHYGVRY-UHFFFAOYSA-N
XLogP2.31
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 52.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 4-cyclobutyl-6-methyl-2-(3-pyrazol-1-ylazetidin-1-yl)pyrimidine 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 4-cyclobutyl-6-methyl-2-(3-pyrazol-1-ylazetidin-1-yl)pyrimidine?
The IUPAC name of 4-cyclobutyl-6-methyl-2-(3-pyrazol-1-ylazetidin-1-yl)pyrimidine (CID 56868221) is 4-cyclobutyl-6-methyl-2-(3-pyrazol-1-ylazetidin-1-yl)pyrimidine.
What is the SMILES notation for 4-cyclobutyl-6-methyl-2-(3-pyrazol-1-ylazetidin-1-yl)pyrimidine?
The canonical SMILES for 4-cyclobutyl-6-methyl-2-(3-pyrazol-1-ylazetidin-1-yl)pyrimidine is Cc1cc(C2CCC2)nc(N2CC(n3cccn3)C2)n1.
What is the InChIKey of 4-cyclobutyl-6-methyl-2-(3-pyrazol-1-ylazetidin-1-yl)pyrimidine?
The InChIKey is IJWYIITYHYGVRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5/c1-11-8-14(12-4-2-5-12)18-15(17-11)19-9-13(10-19)20-7-3-6-16-20/h3,6-8,12-13H,2,4-5,9-10H2,1H3.
What are the key properties of 4-cyclobutyl-6-methyl-2-(3-pyrazol-1-ylazetidin-1-yl)pyrimidine?
4-cyclobutyl-6-methyl-2-(3-pyrazol-1-ylazetidin-1-yl)pyrimidine has a molecular weight of 269.35 g/mol, XLogP of 2.31, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclobutyl-6-methyl-2-(3-pyrazol-1-ylazetidin-1-yl)pyrimidine is sourced from PubChem (CID 56868221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).