4-methyl-6-(1-methylpiperidin-3-yl)-2-pyrrolidin-3-ylpyrimidine

C15H24N4 — CID 116893403

IUPAC4-methyl-6-(1-methylpiperidin-3-yl)-2-pyrrolidin-3-ylpyrimidine
SMILESCc1cc(C2CCCN(C)C2)nc(C2CCNC2)n1
InChIInChI=1S/C15H24N4/c1-11-8-14(13-4-3-7-19(2)10-13)18-15(17-11)12-5-6-16-9-12/h8,12-13,16H,3-7,9-10H2,1-2H3
InChIKeyJENKFGMIBQDXJH-UHFFFAOYSA-N
MW260.38 g/mol
LogP1.67
Rot. Bonds2

About 4-methyl-6-(1-methylpiperidin-3-yl)-2-pyrrolidin-3-ylpyrimidine

4-methyl-6-(1-methylpiperidin-3-yl)-2-pyrrolidin-3-ylpyrimidine (PubChem CID 116893403) has the molecular formula C15H24N4 and a molecular weight of 260.38 g/mol. Its IUPAC name is 4-methyl-6-(1-methylpiperidin-3-yl)-2-pyrrolidin-3-ylpyrimidine.

Molecular Properties

Compound Name4-methyl-6-(1-methylpiperidin-3-yl)-2-pyrrolidin-3-ylpyrimidine
PubChem CID116893403
Molecular FormulaC15H24N4
Molecular Weight260.38 g/mol
Exact Mass260.20
IUPAC Name4-methyl-6-(1-methylpiperidin-3-yl)-2-pyrrolidin-3-ylpyrimidine
SMILESCc1cc(C2CCCN(C)C2)nc(C2CCNC2)n1
InChIInChI=1S/C15H24N4/c1-11-8-14(13-4-3-7-19(2)10-13)18-15(17-11)12-5-6-16-9-12/h8,12-13,16H,3-7,9-10H2,1-2H3
InChIKeyJENKFGMIBQDXJH-UHFFFAOYSA-N
XLogP1.67
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-cyclopentyl-6-methyl-2-piperidin-3-ylpyrimidine
CID 55203946
[4-methyl-6-(1-methylpiperidin-3-yl)pyrimidin-2-yl]methanamine
CID 116892379
4,6-dimethyl-2-piperidin-3-ylpyrimidine
CID 63317441
4,6-dimethyl-2-piperidin-3-ylpyrimidine;dihydrochloride
CID 71299007
[4-methyl-6-(1-methylpiperidin-3-yl)pyrimidin-2-yl]methanethiol
CID 116894539
2-[4-methyl-6-(1-methylpiperidin-3-yl)pyrimidin-2-yl]propan-1-amine
CID 116892733
N,N,2-trimethyl-6-[(3R)-1-methylpiperidin-3-yl]pyridin-4-amine
CID 125000369
4-(1-methylpiperidin-3-yl)-2-piperidin-4-yl-1,3-thiazole
CID 116965401
4-methyl-6-(1-methylpiperidin-3-yl)-2-(piperidin-1-ylmethyl)pyrimidine
CID 172524149
4-methyl-2-[6-methyl-2-(1-methylpiperidin-3-yl)pyrimidin-4-yl]-1,3-thiazole
CID 110100437
4-(2,3-dimethylimidazol-4-yl)-6-methyl-2-[(3R)-1-methylpiperidin-3-yl]pyrimidine
CID 124997329
4,5-dimethyl-N-[6-methyl-2-(1-methylpiperidin-3-yl)pyrimidin-4-yl]-1,3-thiazol-2-amine
CID 110095386

Frequently Asked Questions

What is the IUPAC name of 4-methyl-6-(1-methylpiperidin-3-yl)-2-pyrrolidin-3-ylpyrimidine?
The IUPAC name of 4-methyl-6-(1-methylpiperidin-3-yl)-2-pyrrolidin-3-ylpyrimidine (CID 116893403) is 4-methyl-6-(1-methylpiperidin-3-yl)-2-pyrrolidin-3-ylpyrimidine.
What is the SMILES notation for 4-methyl-6-(1-methylpiperidin-3-yl)-2-pyrrolidin-3-ylpyrimidine?
The canonical SMILES for 4-methyl-6-(1-methylpiperidin-3-yl)-2-pyrrolidin-3-ylpyrimidine is Cc1cc(C2CCCN(C)C2)nc(C2CCNC2)n1.
What is the InChIKey of 4-methyl-6-(1-methylpiperidin-3-yl)-2-pyrrolidin-3-ylpyrimidine?
The InChIKey is JENKFGMIBQDXJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4/c1-11-8-14(13-4-3-7-19(2)10-13)18-15(17-11)12-5-6-16-9-12/h8,12-13,16H,3-7,9-10H2,1-2H3.
What are the key properties of 4-methyl-6-(1-methylpiperidin-3-yl)-2-pyrrolidin-3-ylpyrimidine?
4-methyl-6-(1-methylpiperidin-3-yl)-2-pyrrolidin-3-ylpyrimidine has a molecular weight of 260.38 g/mol, XLogP of 1.67, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-6-(1-methylpiperidin-3-yl)-2-pyrrolidin-3-ylpyrimidine is sourced from PubChem (CID 116893403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).