2,4-dimethyl-5-piperidin-1-ylpyrimidine

C11H17N3 — CID 174735831

IUPAC2,4-dimethyl-5-piperidin-1-ylpyrimidine
SMILESCc1ncc(N2CCCCC2)c(C)n1
InChIInChI=1S/C11H17N3/c1-9-11(8-12-10(2)13-9)14-6-4-3-5-7-14/h8H,3-7H2,1-2H3
InChIKeyVZERSCODOJTLMD-UHFFFAOYSA-N
MW191.28 g/mol
LogP2.08
Rot. Bonds1

About 2,4-dimethyl-5-piperidin-1-ylpyrimidine

2,4-dimethyl-5-piperidin-1-ylpyrimidine (PubChem CID 174735831) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is 2,4-dimethyl-5-piperidin-1-ylpyrimidine.

Molecular Properties

Compound Name2,4-dimethyl-5-piperidin-1-ylpyrimidine
PubChem CID174735831
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC Name2,4-dimethyl-5-piperidin-1-ylpyrimidine
SMILESCc1ncc(N2CCCCC2)c(C)n1
InChIInChI=1S/C11H17N3/c1-9-11(8-12-10(2)13-9)14-6-4-3-5-7-14/h8H,3-7H2,1-2H3
InChIKeyVZERSCODOJTLMD-UHFFFAOYSA-N
XLogP2.08
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 52.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-5-piperidin-1-ylpyrimidine?
The IUPAC name of 2,4-dimethyl-5-piperidin-1-ylpyrimidine (CID 174735831) is 2,4-dimethyl-5-piperidin-1-ylpyrimidine.
What is the SMILES notation for 2,4-dimethyl-5-piperidin-1-ylpyrimidine?
The canonical SMILES for 2,4-dimethyl-5-piperidin-1-ylpyrimidine is Cc1ncc(N2CCCCC2)c(C)n1.
What is the InChIKey of 2,4-dimethyl-5-piperidin-1-ylpyrimidine?
The InChIKey is VZERSCODOJTLMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3/c1-9-11(8-12-10(2)13-9)14-6-4-3-5-7-14/h8H,3-7H2,1-2H3.
What are the key properties of 2,4-dimethyl-5-piperidin-1-ylpyrimidine?
2,4-dimethyl-5-piperidin-1-ylpyrimidine has a molecular weight of 191.28 g/mol, XLogP of 2.08, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-5-piperidin-1-ylpyrimidine is sourced from PubChem (CID 174735831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).