4,6-dimethylpyrimidin-2-amine

C6H9N3 — CID 13021

IUPAC4,6-dimethylpyrimidin-2-amine
SMILESCc1cc(C)nc(N)n1
InChIInChI=1S/C6H9N3/c1-4-3-5(2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)
InChIKeyIDQNBVFPZMCDDN-UHFFFAOYSA-N
MW123.16 g/mol
LogP0.68
Rot. Bonds

About 4,6-dimethylpyrimidin-2-amine

4,6-dimethylpyrimidin-2-amine (PubChem CID 13021) has the molecular formula C6H9N3 and a molecular weight of 123.16 g/mol. Its IUPAC name is 4,6-dimethylpyrimidin-2-amine.

Molecular Properties

Compound Name4,6-dimethylpyrimidin-2-amine
PubChem CID13021
Molecular FormulaC6H9N3
Molecular Weight123.16 g/mol
Exact Mass123.08
IUPAC Name4,6-dimethylpyrimidin-2-amine
SMILESCc1cc(C)nc(N)n1
InChIInChI=1S/C6H9N3/c1-4-3-5(2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)
InChIKeyIDQNBVFPZMCDDN-UHFFFAOYSA-N
XLogP0.68
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500123.16
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-Cyclopropyl-6-methyl-2-pyrimidinamine
CID 13672658
2-Chloro-4,6-dimethylpyrimidine
CID 20550
4-Methyl-6-(trifluoromethyl)-2-pyrimidinamine
CID 600769
2,6-Dimethyl-4-aminopyrimidine
CID 68039
4,6-Dimethylpyrimidine
CID 15257
2-[(4,6-Dimethylpyrimidin-2-yl)disulfanyl]-4,6-dimethylpyrimidine
CID 736679
4,6-Dimethylpyrimidin-2-ylthiourea
CID 747500
2-Chloro-6-methylpyrimidin-4-amine
CID 312629
2,4-Difluoro-6-methylpyrimidine
CID 336951
2-Hydrazinyl-4,6-dimethylpyrimidine
CID 350535
4-(1,1-Dimethylethyl)-6-(trifluoromethyl)-2-pyrimidinamine
CID 691237
2-Amino-5-bromo-4,6-dimethylpyrimidine
CID 2737735

Frequently Asked Questions

What is the IUPAC name of 4,6-dimethylpyrimidin-2-amine?
The IUPAC name of 4,6-dimethylpyrimidin-2-amine (CID 13021) is 4,6-dimethylpyrimidin-2-amine.
What is the SMILES notation for 4,6-dimethylpyrimidin-2-amine?
The canonical SMILES for 4,6-dimethylpyrimidin-2-amine is Cc1cc(C)nc(N)n1.
What is the InChIKey of 4,6-dimethylpyrimidin-2-amine?
The InChIKey is IDQNBVFPZMCDDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3/c1-4-3-5(2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9).
What are the key properties of 4,6-dimethylpyrimidin-2-amine?
4,6-dimethylpyrimidin-2-amine has a molecular weight of 123.16 g/mol, XLogP of 0.68, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dimethylpyrimidin-2-amine is sourced from PubChem (CID 13021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).