6-chloro-2-cyclopropyl-5-methylpyrimidin-4-amine

C8H10ClN3 — CID 77230235

IUPAC6-chloro-2-cyclopropyl-5-methylpyrimidin-4-amine
SMILESCc1c(N)nc(C2CC2)nc1Cl
InChIInChI=1S/C8H10ClN3/c1-4-6(9)11-8(5-2-3-5)12-7(4)10/h5H,2-3H2,1H3,(H2,10,11,12)
InChIKeyYAXGQELQDGLZKV-UHFFFAOYSA-N
MW183.64 g/mol
LogP1.90
Rot. Bonds1

About 6-chloro-2-cyclopropyl-5-methylpyrimidin-4-amine

6-chloro-2-cyclopropyl-5-methylpyrimidin-4-amine (PubChem CID 77230235) has the molecular formula C8H10ClN3 and a molecular weight of 183.64 g/mol. Its IUPAC name is 6-chloro-2-cyclopropyl-5-methylpyrimidin-4-amine.

Molecular Properties

Compound Name6-chloro-2-cyclopropyl-5-methylpyrimidin-4-amine
PubChem CID77230235
Molecular FormulaC8H10ClN3
Molecular Weight183.64 g/mol
Exact Mass183.06
IUPAC Name6-chloro-2-cyclopropyl-5-methylpyrimidin-4-amine
SMILESCc1c(N)nc(C2CC2)nc1Cl
InChIInChI=1S/C8H10ClN3/c1-4-6(9)11-8(5-2-3-5)12-7(4)10/h5H,2-3H2,1H3,(H2,10,11,12)
InChIKeyYAXGQELQDGLZKV-UHFFFAOYSA-N
XLogP1.90
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.64
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-chloro-2-cyclopropyl-5-methylpyrimidin-4-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 6-chloro-2-cyclopropyl-5-methylpyrimidin-4-amine?
The IUPAC name of 6-chloro-2-cyclopropyl-5-methylpyrimidin-4-amine (CID 77230235) is 6-chloro-2-cyclopropyl-5-methylpyrimidin-4-amine.
What is the SMILES notation for 6-chloro-2-cyclopropyl-5-methylpyrimidin-4-amine?
The canonical SMILES for 6-chloro-2-cyclopropyl-5-methylpyrimidin-4-amine is Cc1c(N)nc(C2CC2)nc1Cl.
What is the InChIKey of 6-chloro-2-cyclopropyl-5-methylpyrimidin-4-amine?
The InChIKey is YAXGQELQDGLZKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10ClN3/c1-4-6(9)11-8(5-2-3-5)12-7(4)10/h5H,2-3H2,1H3,(H2,10,11,12).
What are the key properties of 6-chloro-2-cyclopropyl-5-methylpyrimidin-4-amine?
6-chloro-2-cyclopropyl-5-methylpyrimidin-4-amine has a molecular weight of 183.64 g/mol, XLogP of 1.90, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-cyclopropyl-5-methylpyrimidin-4-amine is sourced from PubChem (CID 77230235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).