2-cyclopropyl-4,5-dimethyl-6-[4-(4-methylpyrimidin-2-yl)piperazin-1-yl]pyrimidine

C18H24N6 — CID 154882524

IUPAC2-cyclopropyl-4,5-dimethyl-6-[4-(4-methylpyrimidin-2-yl)piperazin-1-yl]pyrimidine
SMILESCc1ccnc(N2CCN(c3nc(C4CC4)nc(C)c3C)CC2)n1
InChIInChI=1S/C18H24N6/c1-12-6-7-19-18(20-12)24-10-8-23(9-11-24)17-13(2)14(3)21-16(22-17)15-4-5-15/h6-7,15H,4-5,8-11H2,1-3H3
InChIKeyOAUKDCFWCWQLSL-UHFFFAOYSA-N
MW324.43 g/mol
LogP2.40
Rot. Bonds3

About 2-cyclopropyl-4,5-dimethyl-6-[4-(4-methylpyrimidin-2-yl)piperazin-1-yl]pyrimidine

2-cyclopropyl-4,5-dimethyl-6-[4-(4-methylpyrimidin-2-yl)piperazin-1-yl]pyrimidine (PubChem CID 154882524) has the molecular formula C18H24N6 and a molecular weight of 324.43 g/mol. Its IUPAC name is 2-cyclopropyl-4,5-dimethyl-6-[4-(4-methylpyrimidin-2-yl)piperazin-1-yl]pyrimidine.

Molecular Properties

Compound Name2-cyclopropyl-4,5-dimethyl-6-[4-(4-methylpyrimidin-2-yl)piperazin-1-yl]pyrimidine
PubChem CID154882524
Molecular FormulaC18H24N6
Molecular Weight324.43 g/mol
Exact Mass324.21
IUPAC Name2-cyclopropyl-4,5-dimethyl-6-[4-(4-methylpyrimidin-2-yl)piperazin-1-yl]pyrimidine
SMILESCc1ccnc(N2CCN(c3nc(C4CC4)nc(C)c3C)CC2)n1
InChIInChI=1S/C18H24N6/c1-12-6-7-19-18(20-12)24-10-8-23(9-11-24)17-13(2)14(3)21-16(22-17)15-4-5-15/h6-7,15H,4-5,8-11H2,1-3H3
InChIKeyOAUKDCFWCWQLSL-UHFFFAOYSA-N
XLogP2.40
TPSA58.04 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.43
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

4-[4-(2-cyclopropyl-5,6-dimethylpyrimidin-4-yl)piperazin-1-yl]pyrido[3,4-d]pyrimidine
CID 154882881
4-methyl-2-(4-methylpiperazin-1-yl)pyrimidine
CID 15132532
4-methyl-2-(4-methylpiperazin-1-yl)pyrimidine;dihydrochloride
CID 22152276
ethane;4-methyl-2-pyrrolidin-1-ylpyrimidine
CID 178079017
cyclopropyl-[4-(2-cyclopropyl-5,6-dimethylpyrimidin-4-yl)piperazin-1-yl]methanone
CID 154882571
2-(4-ethylpiperidin-1-yl)-4-methylpyrimidine
CID 170581547
5-chloro-6-[4-(2-cyclopropyl-5,6-dimethylpyrimidin-4-yl)piperazin-1-yl]pyridine-3-carbonitrile
CID 154882666
4-[4-(2-cyclopropyl-5,6-dimethylpyrimidin-4-yl)piperazin-1-yl]-1,6-dimethylpyrazolo[5,4-d]pyrimidine
CID 154882886
2-[(3S)-3-fluoropiperidin-1-yl]-4-methylpyrimidine
CID 129349446
2-cyclopropyl-4-methyl-6-[4-(4-pyridin-4-ylpyrimidin-2-yl)piperazin-1-yl]pyrimidine
CID 163348410
(2-cyclopropyl-4-methylpyrimidin-5-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone
CID 74235155
4-methyl-2-(3-methylpiperidin-1-yl)pyrimidine
CID 89079553

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-4,5-dimethyl-6-[4-(4-methylpyrimidin-2-yl)piperazin-1-yl]pyrimidine?
The IUPAC name of 2-cyclopropyl-4,5-dimethyl-6-[4-(4-methylpyrimidin-2-yl)piperazin-1-yl]pyrimidine (CID 154882524) is 2-cyclopropyl-4,5-dimethyl-6-[4-(4-methylpyrimidin-2-yl)piperazin-1-yl]pyrimidine.
What is the SMILES notation for 2-cyclopropyl-4,5-dimethyl-6-[4-(4-methylpyrimidin-2-yl)piperazin-1-yl]pyrimidine?
The canonical SMILES for 2-cyclopropyl-4,5-dimethyl-6-[4-(4-methylpyrimidin-2-yl)piperazin-1-yl]pyrimidine is Cc1ccnc(N2CCN(c3nc(C4CC4)nc(C)c3C)CC2)n1.
What is the InChIKey of 2-cyclopropyl-4,5-dimethyl-6-[4-(4-methylpyrimidin-2-yl)piperazin-1-yl]pyrimidine?
The InChIKey is OAUKDCFWCWQLSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N6/c1-12-6-7-19-18(20-12)24-10-8-23(9-11-24)17-13(2)14(3)21-16(22-17)15-4-5-15/h6-7,15H,4-5,8-11H2,1-3H3.
What are the key properties of 2-cyclopropyl-4,5-dimethyl-6-[4-(4-methylpyrimidin-2-yl)piperazin-1-yl]pyrimidine?
2-cyclopropyl-4,5-dimethyl-6-[4-(4-methylpyrimidin-2-yl)piperazin-1-yl]pyrimidine has a molecular weight of 324.43 g/mol, XLogP of 2.40, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-4,5-dimethyl-6-[4-(4-methylpyrimidin-2-yl)piperazin-1-yl]pyrimidine is sourced from PubChem (CID 154882524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).