3-methyl-1-(pyridin-4-ylmethyl)piperidin-3-ol

C12H18N2O — CID 70987405

IUPAC3-methyl-1-(pyridin-4-ylmethyl)piperidin-3-ol
SMILESCC1(O)CCCN(Cc2ccncc2)C1
InChIInChI=1S/C12H18N2O/c1-12(15)5-2-8-14(10-12)9-11-3-6-13-7-4-11/h3-4,6-7,15H,2,5,8-10H2,1H3
InChIKeyHDVXAXCDGIARNT-UHFFFAOYSA-N
MW206.29 g/mol
LogP1.43
Rot. Bonds2

About 3-methyl-1-(pyridin-4-ylmethyl)piperidin-3-ol

3-methyl-1-(pyridin-4-ylmethyl)piperidin-3-ol (PubChem CID 70987405) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is 3-methyl-1-(pyridin-4-ylmethyl)piperidin-3-ol.

Molecular Properties

Compound Name3-methyl-1-(pyridin-4-ylmethyl)piperidin-3-ol
PubChem CID70987405
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC Name3-methyl-1-(pyridin-4-ylmethyl)piperidin-3-ol
SMILESCC1(O)CCCN(Cc2ccncc2)C1
InChIInChI=1S/C12H18N2O/c1-12(15)5-2-8-14(10-12)9-11-3-6-13-7-4-11/h3-4,6-7,15H,2,5,8-10H2,1H3
InChIKeyHDVXAXCDGIARNT-UHFFFAOYSA-N
XLogP1.43
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-methyl-1-(pyridin-4-ylmethyl)pyrrolidin-3-ol
CID 103729349
1-benzyl-3-methylpiperidin-3-ol
CID 15283107
3-methyl-1-[(4-methylsulfanylphenyl)methyl]piperidin-3-ol
CID 115874101
(3S)-N,N,3-trimethyl-1-(pyridin-4-ylmethyl)piperidine-3-carboxamide
CID 124989292
3-methyl-1-(pyridin-2-ylmethyl)piperidin-3-ol
CID 115873664
1-[(3,4-difluorophenyl)methyl]-3-methylpiperidin-3-ol
CID 115873594
1-[(4-chloro-3-fluorophenyl)methyl]-3-methylpiperidin-3-ol
CID 103887242
2-[4-[(3-hydroxy-3-methylpiperidin-1-yl)methyl]phenyl]acetohydrazide
CID 105352110
1-[(4-fluorophenyl)methyl]-3-methylpyrrolidin-3-ol
CID 103728801
[3-(2-methoxyethyl)-1-(pyridin-4-ylmethyl)piperidin-3-yl]methanol
CID 72912581
3-(2-methoxyethyl)-1-(pyridin-4-ylmethyl)piperidine-3-carboxylic acid
CID 72881029
1-[(2,6-difluorophenyl)methyl]-3-methylpiperidin-3-ol
CID 115883312

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-(pyridin-4-ylmethyl)piperidin-3-ol?
The IUPAC name of 3-methyl-1-(pyridin-4-ylmethyl)piperidin-3-ol (CID 70987405) is 3-methyl-1-(pyridin-4-ylmethyl)piperidin-3-ol.
What is the SMILES notation for 3-methyl-1-(pyridin-4-ylmethyl)piperidin-3-ol?
The canonical SMILES for 3-methyl-1-(pyridin-4-ylmethyl)piperidin-3-ol is CC1(O)CCCN(Cc2ccncc2)C1.
What is the InChIKey of 3-methyl-1-(pyridin-4-ylmethyl)piperidin-3-ol?
The InChIKey is HDVXAXCDGIARNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O/c1-12(15)5-2-8-14(10-12)9-11-3-6-13-7-4-11/h3-4,6-7,15H,2,5,8-10H2,1H3.
What are the key properties of 3-methyl-1-(pyridin-4-ylmethyl)piperidin-3-ol?
3-methyl-1-(pyridin-4-ylmethyl)piperidin-3-ol has a molecular weight of 206.29 g/mol, XLogP of 1.43, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-(pyridin-4-ylmethyl)piperidin-3-ol is sourced from PubChem (CID 70987405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).