6-methyl-4-(piperidin-1-ylmethyl)-1,2-dihydropyrimidine

C11H19N3 — CID 118486713

IUPAC6-methyl-4-(piperidin-1-ylmethyl)-1,2-dihydropyrimidine
SMILESCC1=CC(CN2CCCCC2)=NCN1
InChIInChI=1S/C11H19N3/c1-10-7-11(13-9-12-10)8-14-5-3-2-4-6-14/h7,12H,2-6,8-9H2,1H3
InChIKeyUJMAIZXTTHHYLU-UHFFFAOYSA-N
MW193.29 g/mol
LogP1.38
Rot. Bonds2

About 6-methyl-4-(piperidin-1-ylmethyl)-1,2-dihydropyrimidine

6-methyl-4-(piperidin-1-ylmethyl)-1,2-dihydropyrimidine (PubChem CID 118486713) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is 6-methyl-4-(piperidin-1-ylmethyl)-1,2-dihydropyrimidine.

Molecular Properties

Compound Name6-methyl-4-(piperidin-1-ylmethyl)-1,2-dihydropyrimidine
PubChem CID118486713
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC Name6-methyl-4-(piperidin-1-ylmethyl)-1,2-dihydropyrimidine
SMILESCC1=CC(CN2CCCCC2)=NCN1
InChIInChI=1S/C11H19N3/c1-10-7-11(13-9-12-10)8-14-5-3-2-4-6-14/h7,12H,2-6,8-9H2,1H3
InChIKeyUJMAIZXTTHHYLU-UHFFFAOYSA-N
XLogP1.38
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-4-(piperidin-1-ylmethyl)-1,2-dihydropyrimidine?
The IUPAC name of 6-methyl-4-(piperidin-1-ylmethyl)-1,2-dihydropyrimidine (CID 118486713) is 6-methyl-4-(piperidin-1-ylmethyl)-1,2-dihydropyrimidine.
What is the SMILES notation for 6-methyl-4-(piperidin-1-ylmethyl)-1,2-dihydropyrimidine?
The canonical SMILES for 6-methyl-4-(piperidin-1-ylmethyl)-1,2-dihydropyrimidine is CC1=CC(CN2CCCCC2)=NCN1.
What is the InChIKey of 6-methyl-4-(piperidin-1-ylmethyl)-1,2-dihydropyrimidine?
The InChIKey is UJMAIZXTTHHYLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-10-7-11(13-9-12-10)8-14-5-3-2-4-6-14/h7,12H,2-6,8-9H2,1H3.
What are the key properties of 6-methyl-4-(piperidin-1-ylmethyl)-1,2-dihydropyrimidine?
6-methyl-4-(piperidin-1-ylmethyl)-1,2-dihydropyrimidine has a molecular weight of 193.29 g/mol, XLogP of 1.38, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-4-(piperidin-1-ylmethyl)-1,2-dihydropyrimidine is sourced from PubChem (CID 118486713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).