5-methyl-4-N-(1-methylpyrazol-4-yl)-2-propan-2-yl-6-N-propylpyrimidine-4,6-diamine

C15H24N6 — CID 80991736

IUPAC5-methyl-4-N-(1-methylpyrazol-4-yl)-2-propan-2-yl-6-N-propylpyrimidine-4,6-diamine
SMILESCCCNc1nc(C(C)C)nc(Nc2cnn(C)c2)c1C
InChIInChI=1S/C15H24N6/c1-6-7-16-14-11(4)15(20-13(19-14)10(2)3)18-12-8-17-21(5)9-12/h8-10H,6-7H2,1-5H3,(H2,16,18,19,20)
InChIKeyPBOSSNDZYINKII-UHFFFAOYSA-N
MW288.40 g/mol
LogP3.21
Rot. Bonds6

About 5-methyl-4-N-(1-methylpyrazol-4-yl)-2-propan-2-yl-6-N-propylpyrimidine-4,6-diamine

5-methyl-4-N-(1-methylpyrazol-4-yl)-2-propan-2-yl-6-N-propylpyrimidine-4,6-diamine (PubChem CID 80991736) has the molecular formula C15H24N6 and a molecular weight of 288.40 g/mol. Its IUPAC name is 5-methyl-4-N-(1-methylpyrazol-4-yl)-2-propan-2-yl-6-N-propylpyrimidine-4,6-diamine.

Molecular Properties

Compound Name5-methyl-4-N-(1-methylpyrazol-4-yl)-2-propan-2-yl-6-N-propylpyrimidine-4,6-diamine
PubChem CID80991736
Molecular FormulaC15H24N6
Molecular Weight288.40 g/mol
Exact Mass288.21
IUPAC Name5-methyl-4-N-(1-methylpyrazol-4-yl)-2-propan-2-yl-6-N-propylpyrimidine-4,6-diamine
SMILESCCCNc1nc(C(C)C)nc(Nc2cnn(C)c2)c1C
InChIInChI=1S/C15H24N6/c1-6-7-16-14-11(4)15(20-13(19-14)10(2)3)18-12-8-17-21(5)9-12/h8-10H,6-7H2,1-5H3,(H2,16,18,19,20)
InChIKeyPBOSSNDZYINKII-UHFFFAOYSA-N
XLogP3.21
TPSA67.66 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.40
LogP ≤ 53.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-cyclopropyl-5-methyl-4-N-(1-methylpyrazol-4-yl)-6-N-propylpyrimidine-4,6-diamine
CID 80992491
2-tert-butyl-6-N-ethyl-5-methyl-4-N-(1-methylpyrazol-4-yl)pyrimidine-4,6-diamine
CID 80992025
4-N-butyl-5-methyl-2-propan-2-yl-6-N-propylpyrimidine-4,6-diamine
CID 80980995
5-methyl-6-(4-methylpyrazol-1-yl)-2-propan-2-yl-N-propylpyrimidin-4-amine
CID 80992723
2-[[5-methyl-2-propan-2-yl-6-(propylamino)pyrimidin-4-yl]amino]ethanol
CID 80981937
2-ethyl-6-N,5-dimethyl-4-N-(1-methylpyrazol-4-yl)pyrimidine-4,6-diamine
CID 80992962
6-hydrazinyl-5-methyl-N-(1-methylpyrazol-4-yl)-2-propylpyrimidin-4-amine
CID 81006835
2-methyl-3-[[5-methyl-2-propan-2-yl-6-(propylamino)pyrimidin-4-yl]amino]propan-1-ol
CID 80991979
5-methyl-4-N-(3-methylsulfanylpropyl)-2-propan-2-yl-6-N-propylpyrimidine-4,6-diamine
CID 80984789
4-N-(3,3-dimethylbutan-2-yl)-5-methyl-2-propan-2-yl-6-N-propylpyrimidine-4,6-diamine
CID 104830615
4-N-(2,2-dimethylcyclopropyl)-5-methyl-2-propan-2-yl-6-N-propylpyrimidine-4,6-diamine
CID 80982653
2-methyl-1-[[5-methyl-2-propan-2-yl-6-(propylamino)pyrimidin-4-yl]amino]butan-2-ol
CID 80981087

Frequently Asked Questions

What is the IUPAC name of 5-methyl-4-N-(1-methylpyrazol-4-yl)-2-propan-2-yl-6-N-propylpyrimidine-4,6-diamine?
The IUPAC name of 5-methyl-4-N-(1-methylpyrazol-4-yl)-2-propan-2-yl-6-N-propylpyrimidine-4,6-diamine (CID 80991736) is 5-methyl-4-N-(1-methylpyrazol-4-yl)-2-propan-2-yl-6-N-propylpyrimidine-4,6-diamine.
What is the SMILES notation for 5-methyl-4-N-(1-methylpyrazol-4-yl)-2-propan-2-yl-6-N-propylpyrimidine-4,6-diamine?
The canonical SMILES for 5-methyl-4-N-(1-methylpyrazol-4-yl)-2-propan-2-yl-6-N-propylpyrimidine-4,6-diamine is CCCNc1nc(C(C)C)nc(Nc2cnn(C)c2)c1C.
What is the InChIKey of 5-methyl-4-N-(1-methylpyrazol-4-yl)-2-propan-2-yl-6-N-propylpyrimidine-4,6-diamine?
The InChIKey is PBOSSNDZYINKII-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N6/c1-6-7-16-14-11(4)15(20-13(19-14)10(2)3)18-12-8-17-21(5)9-12/h8-10H,6-7H2,1-5H3,(H2,16,18,19,20).
What are the key properties of 5-methyl-4-N-(1-methylpyrazol-4-yl)-2-propan-2-yl-6-N-propylpyrimidine-4,6-diamine?
5-methyl-4-N-(1-methylpyrazol-4-yl)-2-propan-2-yl-6-N-propylpyrimidine-4,6-diamine has a molecular weight of 288.40 g/mol, XLogP of 3.21, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-4-N-(1-methylpyrazol-4-yl)-2-propan-2-yl-6-N-propylpyrimidine-4,6-diamine is sourced from PubChem (CID 80991736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).