2-cyclopropyl-5-methyl-6-(2-methylpropyl)-N-propylpyrimidin-4-amine

C15H25N3 — CID 80976122

IUPAC2-cyclopropyl-5-methyl-6-(2-methylpropyl)-N-propylpyrimidin-4-amine
SMILESCCCNc1nc(C2CC2)nc(CC(C)C)c1C
InChIInChI=1S/C15H25N3/c1-5-8-16-14-11(4)13(9-10(2)3)17-15(18-14)12-6-7-12/h10,12H,5-9H2,1-4H3,(H,16,17,18)
InChIKeyKQHPTOOGXFWUMZ-UHFFFAOYSA-N
MW247.39 g/mol
LogP3.68
Rot. Bonds6

About 2-cyclopropyl-5-methyl-6-(2-methylpropyl)-N-propylpyrimidin-4-amine

2-cyclopropyl-5-methyl-6-(2-methylpropyl)-N-propylpyrimidin-4-amine (PubChem CID 80976122) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is 2-cyclopropyl-5-methyl-6-(2-methylpropyl)-N-propylpyrimidin-4-amine.

Molecular Properties

Compound Name2-cyclopropyl-5-methyl-6-(2-methylpropyl)-N-propylpyrimidin-4-amine
PubChem CID80976122
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC Name2-cyclopropyl-5-methyl-6-(2-methylpropyl)-N-propylpyrimidin-4-amine
SMILESCCCNc1nc(C2CC2)nc(CC(C)C)c1C
InChIInChI=1S/C15H25N3/c1-5-8-16-14-11(4)13(9-10(2)3)17-15(18-14)12-6-7-12/h10,12H,5-9H2,1-4H3,(H,16,17,18)
InChIKeyKQHPTOOGXFWUMZ-UHFFFAOYSA-N
XLogP3.68
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyclopropyl-N-ethyl-5-methyl-6-(2-methylpropyl)pyrimidin-4-amine
CID 80977208
2-cyclopropyl-5-methyl-4-N-(2-methylpropyl)-6-N-propylpyrimidine-4,6-diamine
CID 80980633
2-cyclopropyl-6-hydrazinyl-5-methyl-N-propylpyrimidin-4-amine
CID 81000575
3-[[2-cyclopropyl-5-methyl-6-(propylamino)pyrimidin-4-yl]amino]-2-methylpropan-1-ol
CID 80992823
2-cyclopropyl-5-methyl-6-(4-methylpentan-2-yloxy)-N-propylpyrimidin-4-amine
CID 80988938
2-tert-butyl-5-methyl-6-(2-methylpropyl)-N-propylpyrimidin-4-amine
CID 80977294
2-cyclopropyl-5-methyl-6-pentan-2-yloxy-N-propylpyrimidin-4-amine
CID 102989575
2-cyclopropyl-4-N-(3-methoxy-2-methylpropyl)-5-methyl-6-N-propylpyrimidine-4,6-diamine
CID 80984401
2-cyclopropyl-4-N,5-dimethyl-4-N-(3-methylbutan-2-yl)-6-N-propylpyrimidine-4,6-diamine
CID 80986619
2-cyclopropyl-4-N-(1-cyclopropylethyl)-4-N,5-dimethyl-6-N-propylpyrimidine-4,6-diamine
CID 80986615
2-cyclohexyl-5,6-dimethyl-N-propylpyrimidin-4-amine
CID 63485968
2-cyclopropyl-4-N,5-dimethyl-4-N-pentan-3-yl-6-N-propylpyrimidine-4,6-diamine
CID 80986623

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-5-methyl-6-(2-methylpropyl)-N-propylpyrimidin-4-amine?
The IUPAC name of 2-cyclopropyl-5-methyl-6-(2-methylpropyl)-N-propylpyrimidin-4-amine (CID 80976122) is 2-cyclopropyl-5-methyl-6-(2-methylpropyl)-N-propylpyrimidin-4-amine.
What is the SMILES notation for 2-cyclopropyl-5-methyl-6-(2-methylpropyl)-N-propylpyrimidin-4-amine?
The canonical SMILES for 2-cyclopropyl-5-methyl-6-(2-methylpropyl)-N-propylpyrimidin-4-amine is CCCNc1nc(C2CC2)nc(CC(C)C)c1C.
What is the InChIKey of 2-cyclopropyl-5-methyl-6-(2-methylpropyl)-N-propylpyrimidin-4-amine?
The InChIKey is KQHPTOOGXFWUMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-5-8-16-14-11(4)13(9-10(2)3)17-15(18-14)12-6-7-12/h10,12H,5-9H2,1-4H3,(H,16,17,18).
What are the key properties of 2-cyclopropyl-5-methyl-6-(2-methylpropyl)-N-propylpyrimidin-4-amine?
2-cyclopropyl-5-methyl-6-(2-methylpropyl)-N-propylpyrimidin-4-amine has a molecular weight of 247.39 g/mol, XLogP of 3.68, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-5-methyl-6-(2-methylpropyl)-N-propylpyrimidin-4-amine is sourced from PubChem (CID 80976122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).