(4-methylpyrimidin-2-yl)methanamine

C6H9N3 — CID 18727763

IUPAC(4-methylpyrimidin-2-yl)methanamine
SMILESCc1ccnc(CN)n1
InChIInChI=1S/C6H9N3/c1-5-2-3-8-6(4-7)9-5/h2-3H,4,7H2,1H3
InChIKeyMBVLWFLZWJQUQW-UHFFFAOYSA-N
MW123.16 g/mol
LogP0.24
Rot. Bonds1

About (4-methylpyrimidin-2-yl)methanamine

(4-methylpyrimidin-2-yl)methanamine (PubChem CID 18727763) has the molecular formula C6H9N3 and a molecular weight of 123.16 g/mol. Its IUPAC name is (4-methylpyrimidin-2-yl)methanamine.

Molecular Properties

Compound Name(4-methylpyrimidin-2-yl)methanamine
PubChem CID18727763
Molecular FormulaC6H9N3
Molecular Weight123.16 g/mol
Exact Mass123.08
IUPAC Name(4-methylpyrimidin-2-yl)methanamine
SMILESCc1ccnc(CN)n1
InChIInChI=1S/C6H9N3/c1-5-2-3-8-6(4-7)9-5/h2-3H,4,7H2,1H3
InChIKeyMBVLWFLZWJQUQW-UHFFFAOYSA-N
XLogP0.24
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500123.16
LogP ≤ 50.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (4-methylpyrimidin-2-yl)methanamine with MolForge

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

Launch Full Analysis

Related Compounds

2-Amino-4-methylpyrimidine
CID 7939
2-(Piperazin-1-yl)-4-(trifluoromethyl)pyrimidine
CID 2778334
4-Methylpyrimidine
CID 18922
2-Amino-4-(trifluoromethyl)pyrimidine
CID 595915
6-Methylpyrimidin-4-amine
CID 572852
4-Methyl-2-(methylsulfanyl)pyrimidine
CID 821261
2-Pyrimidinemethanamine
CID 4658047
2-Chloro-4-methylpyrimidine
CID 11629607
2-Fluoro-4-methylpyrimidine
CID 17804394
N-methylpyrimidine-2-carboximidamide
CID 57780677
4-((E)-{[(E)-amino(imino)methyl]hydrazono}methyl)pyrimidine-2-carboximidamide
CID 10398061
5-Amino-4-methylpyrimidine
CID 227541

Frequently Asked Questions

What is the IUPAC name of (4-methylpyrimidin-2-yl)methanamine?
The IUPAC name of (4-methylpyrimidin-2-yl)methanamine (CID 18727763) is (4-methylpyrimidin-2-yl)methanamine.
What is the SMILES notation for (4-methylpyrimidin-2-yl)methanamine?
The canonical SMILES for (4-methylpyrimidin-2-yl)methanamine is Cc1ccnc(CN)n1.
What is the InChIKey of (4-methylpyrimidin-2-yl)methanamine?
The InChIKey is MBVLWFLZWJQUQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3/c1-5-2-3-8-6(4-7)9-5/h2-3H,4,7H2,1H3.
What are the key properties of (4-methylpyrimidin-2-yl)methanamine?
(4-methylpyrimidin-2-yl)methanamine has a molecular weight of 123.16 g/mol, XLogP of 0.24, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methylpyrimidin-2-yl)methanamine is sourced from PubChem (CID 18727763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).