2-cyclopropyl-5-methyl-6-(2-methylimidazol-1-yl)-N-propylpyrimidin-4-amine

C15H21N5 — CID 80992611

IUPAC2-cyclopropyl-5-methyl-6-(2-methylimidazol-1-yl)-N-propylpyrimidin-4-amine
SMILESCCCNc1nc(C2CC2)nc(-n2ccnc2C)c1C
InChIInChI=1S/C15H21N5/c1-4-7-17-13-10(2)15(20-9-8-16-11(20)3)19-14(18-13)12-5-6-12/h8-9,12H,4-7H2,1-3H3,(H,17,18,19)
InChIKeyBSHRAHYERNZROZ-UHFFFAOYSA-N
MW271.37 g/mol
LogP2.98
Rot. Bonds5

About 2-cyclopropyl-5-methyl-6-(2-methylimidazol-1-yl)-N-propylpyrimidin-4-amine

2-cyclopropyl-5-methyl-6-(2-methylimidazol-1-yl)-N-propylpyrimidin-4-amine (PubChem CID 80992611) has the molecular formula C15H21N5 and a molecular weight of 271.37 g/mol. Its IUPAC name is 2-cyclopropyl-5-methyl-6-(2-methylimidazol-1-yl)-N-propylpyrimidin-4-amine.

Molecular Properties

Compound Name2-cyclopropyl-5-methyl-6-(2-methylimidazol-1-yl)-N-propylpyrimidin-4-amine
PubChem CID80992611
Molecular FormulaC15H21N5
Molecular Weight271.37 g/mol
Exact Mass271.18
IUPAC Name2-cyclopropyl-5-methyl-6-(2-methylimidazol-1-yl)-N-propylpyrimidin-4-amine
SMILESCCCNc1nc(C2CC2)nc(-n2ccnc2C)c1C
InChIInChI=1S/C15H21N5/c1-4-7-17-13-10(2)15(20-9-8-16-11(20)3)19-14(18-13)12-5-6-12/h8-9,12H,4-7H2,1-3H3,(H,17,18,19)
InChIKeyBSHRAHYERNZROZ-UHFFFAOYSA-N
XLogP2.98
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.37
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-cyclopropyl-6-(2-ethylimidazol-1-yl)-N,5-dimethylpyrimidin-4-amine
CID 80992904
2-cyclopropyl-5-methyl-6-piperazin-1-yl-N-propylpyrimidin-4-amine
CID 80984339
2-cyclopropyl-5-methyl-6-(1-methylimidazol-2-yl)sulfanyl-N-propylpyrimidin-4-amine
CID 80990773
1-[2-cyclopropyl-5-methyl-6-(propylamino)pyrimidin-4-yl]-3-methylpyrrolidin-3-ol
CID 103358914
N-ethyl-5-methyl-6-(2-methylimidazol-1-yl)-2-propylpyrimidin-4-amine
CID 80992338
2-cyclopropyl-6-hydrazinyl-5-methyl-N-propylpyrimidin-4-amine
CID 81000575
2-cyclopropyl-6-(4,5-dimethylimidazol-1-yl)-N-ethyl-5-methylpyrimidin-4-amine
CID 80988896
2-cyclopropyl-5-methyl-6-(3-methylmorpholin-4-yl)-N-propylpyrimidin-4-amine
CID 80986418
2-cyclopropyl-5-methyl-4-N-(2-methylpropyl)-6-N-propylpyrimidine-4,6-diamine
CID 80980633
2-tert-butyl-N-ethyl-5-methyl-6-(2-methylimidazol-1-yl)pyrimidin-4-amine
CID 80991880
2-cyclohexyl-5,6-dimethyl-N-propylpyrimidin-4-amine
CID 63485968
2-cyclopropyl-5-methyl-6-(2-methylpropyl)-N-propylpyrimidin-4-amine
CID 80976122

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-5-methyl-6-(2-methylimidazol-1-yl)-N-propylpyrimidin-4-amine?
The IUPAC name of 2-cyclopropyl-5-methyl-6-(2-methylimidazol-1-yl)-N-propylpyrimidin-4-amine (CID 80992611) is 2-cyclopropyl-5-methyl-6-(2-methylimidazol-1-yl)-N-propylpyrimidin-4-amine.
What is the SMILES notation for 2-cyclopropyl-5-methyl-6-(2-methylimidazol-1-yl)-N-propylpyrimidin-4-amine?
The canonical SMILES for 2-cyclopropyl-5-methyl-6-(2-methylimidazol-1-yl)-N-propylpyrimidin-4-amine is CCCNc1nc(C2CC2)nc(-n2ccnc2C)c1C.
What is the InChIKey of 2-cyclopropyl-5-methyl-6-(2-methylimidazol-1-yl)-N-propylpyrimidin-4-amine?
The InChIKey is BSHRAHYERNZROZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5/c1-4-7-17-13-10(2)15(20-9-8-16-11(20)3)19-14(18-13)12-5-6-12/h8-9,12H,4-7H2,1-3H3,(H,17,18,19).
What are the key properties of 2-cyclopropyl-5-methyl-6-(2-methylimidazol-1-yl)-N-propylpyrimidin-4-amine?
2-cyclopropyl-5-methyl-6-(2-methylimidazol-1-yl)-N-propylpyrimidin-4-amine has a molecular weight of 271.37 g/mol, XLogP of 2.98, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-5-methyl-6-(2-methylimidazol-1-yl)-N-propylpyrimidin-4-amine is sourced from PubChem (CID 80992611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).