2-(2-methylpyrimidin-4-yl)-6-propan-2-ylpyrimidin-4-amine

C12H15N5 — CID 113329092

IUPAC2-(2-methylpyrimidin-4-yl)-6-propan-2-ylpyrimidin-4-amine
SMILESCc1nccc(-c2nc(N)cc(C(C)C)n2)n1
InChIInChI=1S/C12H15N5/c1-7(2)10-6-11(13)17-12(16-10)9-4-5-14-8(3)15-9/h4-7H,1-3H3,(H2,13,16,17)
InChIKeyAFYCMVLTOADFHO-UHFFFAOYSA-N
MW229.29 g/mol
LogP1.95
Rot. Bonds2

About 2-(2-methylpyrimidin-4-yl)-6-propan-2-ylpyrimidin-4-amine

2-(2-methylpyrimidin-4-yl)-6-propan-2-ylpyrimidin-4-amine (PubChem CID 113329092) has the molecular formula C12H15N5 and a molecular weight of 229.29 g/mol. Its IUPAC name is 2-(2-methylpyrimidin-4-yl)-6-propan-2-ylpyrimidin-4-amine.

Molecular Properties

Compound Name2-(2-methylpyrimidin-4-yl)-6-propan-2-ylpyrimidin-4-amine
PubChem CID113329092
Molecular FormulaC12H15N5
Molecular Weight229.29 g/mol
Exact Mass229.13
IUPAC Name2-(2-methylpyrimidin-4-yl)-6-propan-2-ylpyrimidin-4-amine
SMILESCc1nccc(-c2nc(N)cc(C(C)C)n2)n1
InChIInChI=1S/C12H15N5/c1-7(2)10-6-11(13)17-12(16-10)9-4-5-14-8(3)15-9/h4-7H,1-3H3,(H2,13,16,17)
InChIKeyAFYCMVLTOADFHO-UHFFFAOYSA-N
XLogP1.95
TPSA77.58 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.29
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[2-(2-methylpyrimidin-4-yl)-6-propan-2-ylpyrimidin-4-yl]hydrazine
CID 115528598
6-tert-butyl-2-(2-methylpyrimidin-4-yl)pyrimidin-4-amine
CID 115528413
6-propan-2-yl-2-pyrazin-2-ylpyrimidin-4-amine
CID 62191917
6-propan-2-yl-2-pyrimidin-2-ylpyrimidin-4-amine
CID 62191558
2-(2,4-dimethylphenyl)-6-propan-2-ylpyrimidin-4-amine
CID 55045645
2-(3,4-difluorophenyl)-6-propan-2-ylpyrimidin-4-amine
CID 62191916
1-[3-(2-methylpyrimidin-4-yl)-1,2,4-oxadiazol-5-yl]ethanamine
CID 115529198
6-propan-2-yl-2-(4-propan-2-yloxyphenyl)pyrimidin-4-amine
CID 62201941
6-propan-2-ylpyrimidine-2,4-diamine
CID 12655163
2-(3-chlorophenyl)-6-propan-2-ylpyrimidin-4-amine
CID 62191035
2-naphthalen-1-yl-6-propan-2-ylpyrimidin-4-amine
CID 62203179
1-[2-(2-methylpyrimidin-4-yl)pyrimidin-4-yl]propan-2-amine
CID 115531275

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylpyrimidin-4-yl)-6-propan-2-ylpyrimidin-4-amine?
The IUPAC name of 2-(2-methylpyrimidin-4-yl)-6-propan-2-ylpyrimidin-4-amine (CID 113329092) is 2-(2-methylpyrimidin-4-yl)-6-propan-2-ylpyrimidin-4-amine.
What is the SMILES notation for 2-(2-methylpyrimidin-4-yl)-6-propan-2-ylpyrimidin-4-amine?
The canonical SMILES for 2-(2-methylpyrimidin-4-yl)-6-propan-2-ylpyrimidin-4-amine is Cc1nccc(-c2nc(N)cc(C(C)C)n2)n1.
What is the InChIKey of 2-(2-methylpyrimidin-4-yl)-6-propan-2-ylpyrimidin-4-amine?
The InChIKey is AFYCMVLTOADFHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N5/c1-7(2)10-6-11(13)17-12(16-10)9-4-5-14-8(3)15-9/h4-7H,1-3H3,(H2,13,16,17).
What are the key properties of 2-(2-methylpyrimidin-4-yl)-6-propan-2-ylpyrimidin-4-amine?
2-(2-methylpyrimidin-4-yl)-6-propan-2-ylpyrimidin-4-amine has a molecular weight of 229.29 g/mol, XLogP of 1.95, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylpyrimidin-4-yl)-6-propan-2-ylpyrimidin-4-amine is sourced from PubChem (CID 113329092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).