N-cyclobutylpyrimidin-2-amine

C8H11N3 — CID 45080152

IUPACN-cyclobutylpyrimidin-2-amine
SMILESc1cnc(NC2CCC2)nc1
InChIInChI=1S/C8H11N3/c1-3-7(4-1)11-8-9-5-2-6-10-8/h2,5-7H,1,3-4H2,(H,9,10,11)
InChIKeyMTCKIZRCOIKWSW-UHFFFAOYSA-N
MW149.20 g/mol
LogP1.44
Rot. Bonds2

About N-cyclobutylpyrimidin-2-amine

N-cyclobutylpyrimidin-2-amine (PubChem CID 45080152) has the molecular formula C8H11N3 and a molecular weight of 149.20 g/mol. Its IUPAC name is N-cyclobutylpyrimidin-2-amine.

Molecular Properties

Compound NameN-cyclobutylpyrimidin-2-amine
PubChem CID45080152
Molecular FormulaC8H11N3
Molecular Weight149.20 g/mol
Exact Mass149.10
IUPAC NameN-cyclobutylpyrimidin-2-amine
SMILESc1cnc(NC2CCC2)nc1
InChIInChI=1S/C8H11N3/c1-3-7(4-1)11-8-9-5-2-6-10-8/h2,5-7H,1,3-4H2,(H,9,10,11)
InChIKeyMTCKIZRCOIKWSW-UHFFFAOYSA-N
XLogP1.44
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.20
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-cyclobutylpyrimidin-2-amine 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-cyclobutylpyrimidin-2-amine?
The IUPAC name of N-cyclobutylpyrimidin-2-amine (CID 45080152) is N-cyclobutylpyrimidin-2-amine.
What is the SMILES notation for N-cyclobutylpyrimidin-2-amine?
The canonical SMILES for N-cyclobutylpyrimidin-2-amine is c1cnc(NC2CCC2)nc1.
What is the InChIKey of N-cyclobutylpyrimidin-2-amine?
The InChIKey is MTCKIZRCOIKWSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3/c1-3-7(4-1)11-8-9-5-2-6-10-8/h2,5-7H,1,3-4H2,(H,9,10,11).
What are the key properties of N-cyclobutylpyrimidin-2-amine?
N-cyclobutylpyrimidin-2-amine has a molecular weight of 149.20 g/mol, XLogP of 1.44, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclobutylpyrimidin-2-amine is sourced from PubChem (CID 45080152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).