1-[6-methyl-2-(1-methylpyrrolidin-2-yl)pyrimidin-4-yl]piperidin-4-ol

C15H24N4O — CID 110271365

IUPAC1-[6-methyl-2-(1-methylpyrrolidin-2-yl)pyrimidin-4-yl]piperidin-4-ol
SMILESCc1cc(N2CCC(O)CC2)nc(C2CCCN2C)n1
InChIInChI=1S/C15H24N4O/c1-11-10-14(19-8-5-12(20)6-9-19)17-15(16-11)13-4-3-7-18(13)2/h10,12-13,20H,3-9H2,1-2H3
InChIKeyXBQZRAMFFYUTCH-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.51
Rot. Bonds2

About 1-[6-methyl-2-(1-methylpyrrolidin-2-yl)pyrimidin-4-yl]piperidin-4-ol

1-[6-methyl-2-(1-methylpyrrolidin-2-yl)pyrimidin-4-yl]piperidin-4-ol (PubChem CID 110271365) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is 1-[6-methyl-2-(1-methylpyrrolidin-2-yl)pyrimidin-4-yl]piperidin-4-ol.

Molecular Properties

Compound Name1-[6-methyl-2-(1-methylpyrrolidin-2-yl)pyrimidin-4-yl]piperidin-4-ol
PubChem CID110271365
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC Name1-[6-methyl-2-(1-methylpyrrolidin-2-yl)pyrimidin-4-yl]piperidin-4-ol
SMILESCc1cc(N2CCC(O)CC2)nc(C2CCCN2C)n1
InChIInChI=1S/C15H24N4O/c1-11-10-14(19-8-5-12(20)6-9-19)17-15(16-11)13-4-3-7-18(13)2/h10,12-13,20H,3-9H2,1-2H3
InChIKeyXBQZRAMFFYUTCH-UHFFFAOYSA-N
XLogP1.51
TPSA52.49 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-[6-methyl-2-(1-methylpyrrolidin-2-yl)pyrimidin-4-yl]piperidin-4-ol?
The IUPAC name of 1-[6-methyl-2-(1-methylpyrrolidin-2-yl)pyrimidin-4-yl]piperidin-4-ol (CID 110271365) is 1-[6-methyl-2-(1-methylpyrrolidin-2-yl)pyrimidin-4-yl]piperidin-4-ol.
What is the SMILES notation for 1-[6-methyl-2-(1-methylpyrrolidin-2-yl)pyrimidin-4-yl]piperidin-4-ol?
The canonical SMILES for 1-[6-methyl-2-(1-methylpyrrolidin-2-yl)pyrimidin-4-yl]piperidin-4-ol is Cc1cc(N2CCC(O)CC2)nc(C2CCCN2C)n1.
What is the InChIKey of 1-[6-methyl-2-(1-methylpyrrolidin-2-yl)pyrimidin-4-yl]piperidin-4-ol?
The InChIKey is XBQZRAMFFYUTCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-11-10-14(19-8-5-12(20)6-9-19)17-15(16-11)13-4-3-7-18(13)2/h10,12-13,20H,3-9H2,1-2H3.
What are the key properties of 1-[6-methyl-2-(1-methylpyrrolidin-2-yl)pyrimidin-4-yl]piperidin-4-ol?
1-[6-methyl-2-(1-methylpyrrolidin-2-yl)pyrimidin-4-yl]piperidin-4-ol has a molecular weight of 276.38 g/mol, XLogP of 1.51, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-methyl-2-(1-methylpyrrolidin-2-yl)pyrimidin-4-yl]piperidin-4-ol is sourced from PubChem (CID 110271365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).