6-methylpyrimidin-4-amine

C5H7N3 — CID 572852

IUPAC6-methylpyrimidin-4-amine
SMILESCc1cc(N)ncn1
InChIInChI=1S/C5H7N3/c1-4-2-5(6)8-3-7-4/h2-3H,1H3,(H2,6,7,8)
InChIKeyLAERIBHKDNBVOO-UHFFFAOYSA-N
MW109.13 g/mol
LogP0.37
Rot. Bonds

About 6-methylpyrimidin-4-amine

6-methylpyrimidin-4-amine (PubChem CID 572852) has the molecular formula C5H7N3 and a molecular weight of 109.13 g/mol. Its IUPAC name is 6-methylpyrimidin-4-amine.

Molecular Properties

Compound Name6-methylpyrimidin-4-amine
PubChem CID572852
Molecular FormulaC5H7N3
Molecular Weight109.13 g/mol
Exact Mass109.06
IUPAC Name6-methylpyrimidin-4-amine
SMILESCc1cc(N)ncn1
InChIInChI=1S/C5H7N3/c1-4-2-5(6)8-3-7-4/h2-3H,1H3,(H2,6,7,8)
InChIKeyLAERIBHKDNBVOO-UHFFFAOYSA-N
XLogP0.37
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500109.13
LogP ≤ 50.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-methylpyrimidin-4-amine?
The IUPAC name of 6-methylpyrimidin-4-amine (CID 572852) is 6-methylpyrimidin-4-amine.
What is the SMILES notation for 6-methylpyrimidin-4-amine?
The canonical SMILES for 6-methylpyrimidin-4-amine is Cc1cc(N)ncn1.
What is the InChIKey of 6-methylpyrimidin-4-amine?
The InChIKey is LAERIBHKDNBVOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7N3/c1-4-2-5(6)8-3-7-4/h2-3H,1H3,(H2,6,7,8).
What are the key properties of 6-methylpyrimidin-4-amine?
6-methylpyrimidin-4-amine has a molecular weight of 109.13 g/mol, XLogP of 0.37, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methylpyrimidin-4-amine is sourced from PubChem (CID 572852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).