2-Methylpyrimidin-4-amine

C5H7N3 — CID 295763

IUPAC2-methylpyrimidin-4-amine
SMILESCC1=NC=CC(=N1)N
InChIInChI=1S/C5H7N3/c1-4-7-3-2-5(6)8-4/h2-3H,1H3,(H2,6,7,8)
InChIKeyGKVDLTTVBNOGNJ-UHFFFAOYSA-N
MW109.13 g/mol
LogP0.30
Rot. Bonds

About 2-Methylpyrimidin-4-amine

2-Methylpyrimidin-4-amine (PubChem CID 295763) has the molecular formula C5H7N3 and a molecular weight of 109.13 g/mol. Its IUPAC name is 2-methylpyrimidin-4-amine.

Molecular Properties

Compound Name2-Methylpyrimidin-4-amine
PubChem CID295763
Molecular FormulaC5H7N3
Molecular Weight109.13 g/mol
Exact Mass109.06
IUPAC Name2-methylpyrimidin-4-amine
SMILESCC1=NC=CC(=N1)N
InChIInChI=1S/C5H7N3/c1-4-7-3-2-5(6)8-4/h2-3H,1H3,(H2,6,7,8)
InChIKeyGKVDLTTVBNOGNJ-UHFFFAOYSA-N
XLogP0.30
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms8
Complexity74

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500109.13
LogP ≤ 50.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-Aminopyrimidine
CID 7978
Pyrimidine
CID 9260
4-Amino-2-methyl-5-pyrimidinemethanamine
CID 66762
N-(1-Methylethyl)-2-pyrimidinamine
CID 71169
2-Bromopyrimidine
CID 78345
2,4-Diaminopyrimidine
CID 67431
2-Cyanopyrimidine
CID 2757979
4-Amino-2-methylpyrimidine-5-carbonitrile
CID 69682
N-methylpyrimidin-2-amine
CID 265776
2,5-Dimethylpyrimidin-4-Amine
CID 445779
2-Chloro-N,N-dimethylpyrimidin-4-amine
CID 95975
2-Fluoropyrimidine
CID 141643

Frequently Asked Questions

What is the IUPAC name of 2-Methylpyrimidin-4-amine?
The IUPAC name of 2-Methylpyrimidin-4-amine (CID 295763) is 2-methylpyrimidin-4-amine.
What is the SMILES notation for 2-Methylpyrimidin-4-amine?
The canonical SMILES for 2-Methylpyrimidin-4-amine is CC1=NC=CC(=N1)N.
What is the InChIKey of 2-Methylpyrimidin-4-amine?
The InChIKey is GKVDLTTVBNOGNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7N3/c1-4-7-3-2-5(6)8-4/h2-3H,1H3,(H2,6,7,8).
What are the key properties of 2-Methylpyrimidin-4-amine?
2-Methylpyrimidin-4-amine has a molecular weight of 109.13 g/mol, XLogP of 0.30, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-Methylpyrimidin-4-amine is sourced from PubChem (CID 295763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).