2-methyl-4-(3-methylpiperidin-3-yl)pyrimidine

C11H17N3 — CID 66509816

IUPAC2-methyl-4-(3-methylpiperidin-3-yl)pyrimidine
SMILESCc1nccc(C2(C)CCCNC2)n1
InChIInChI=1S/C11H17N3/c1-9-13-7-4-10(14-9)11(2)5-3-6-12-8-11/h4,7,12H,3,5-6,8H2,1-2H3
InChIKeyGCPPYHXRESKMER-UHFFFAOYSA-N
MW191.28 g/mol
LogP1.43
Rot. Bonds1

About 2-methyl-4-(3-methylpiperidin-3-yl)pyrimidine

2-methyl-4-(3-methylpiperidin-3-yl)pyrimidine (PubChem CID 66509816) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is 2-methyl-4-(3-methylpiperidin-3-yl)pyrimidine.

Molecular Properties

Compound Name2-methyl-4-(3-methylpiperidin-3-yl)pyrimidine
PubChem CID66509816
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC Name2-methyl-4-(3-methylpiperidin-3-yl)pyrimidine
SMILESCc1nccc(C2(C)CCCNC2)n1
InChIInChI=1S/C11H17N3/c1-9-13-7-4-10(14-9)11(2)5-3-6-12-8-11/h4,7,12H,3,5-6,8H2,1-2H3
InChIKeyGCPPYHXRESKMER-UHFFFAOYSA-N
XLogP1.43
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-(3-methylpiperidin-3-yl)pyrimidine?
The IUPAC name of 2-methyl-4-(3-methylpiperidin-3-yl)pyrimidine (CID 66509816) is 2-methyl-4-(3-methylpiperidin-3-yl)pyrimidine.
What is the SMILES notation for 2-methyl-4-(3-methylpiperidin-3-yl)pyrimidine?
The canonical SMILES for 2-methyl-4-(3-methylpiperidin-3-yl)pyrimidine is Cc1nccc(C2(C)CCCNC2)n1.
What is the InChIKey of 2-methyl-4-(3-methylpiperidin-3-yl)pyrimidine?
The InChIKey is GCPPYHXRESKMER-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3/c1-9-13-7-4-10(14-9)11(2)5-3-6-12-8-11/h4,7,12H,3,5-6,8H2,1-2H3.
What are the key properties of 2-methyl-4-(3-methylpiperidin-3-yl)pyrimidine?
2-methyl-4-(3-methylpiperidin-3-yl)pyrimidine has a molecular weight of 191.28 g/mol, XLogP of 1.43, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-(3-methylpiperidin-3-yl)pyrimidine is sourced from PubChem (CID 66509816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).