[5-chloro-2-(2-methylpiperidin-1-yl)-4-pyridinyl]methanol

C12H17ClN2O — CID 114920177

IUPAC[5-chloro-2-(2-methylpiperidin-1-yl)-4-pyridinyl]methanol
SMILESCC1CCCCN1c1cc(CO)c(Cl)cn1
InChIInChI=1S/C12H17ClN2O/c1-9-4-2-3-5-15(9)12-6-10(8-16)11(13)7-14-12/h6-7,9,16H,2-5,8H2,1H3
InChIKeyCPQFYSIBPMPTJI-UHFFFAOYSA-N
MW240.73 g/mol
LogP2.61
Rot. Bonds2

About [5-chloro-2-(2-methylpiperidin-1-yl)-4-pyridinyl]methanol

[5-chloro-2-(2-methylpiperidin-1-yl)-4-pyridinyl]methanol (PubChem CID 114920177) has the molecular formula C12H17ClN2O and a molecular weight of 240.73 g/mol. Its IUPAC name is [5-chloro-2-(2-methylpiperidin-1-yl)-4-pyridinyl]methanol.

Molecular Properties

Compound Name[5-chloro-2-(2-methylpiperidin-1-yl)-4-pyridinyl]methanol
PubChem CID114920177
Molecular FormulaC12H17ClN2O
Molecular Weight240.73 g/mol
Exact Mass240.10
IUPAC Name[5-chloro-2-(2-methylpiperidin-1-yl)-4-pyridinyl]methanol
SMILESCC1CCCCN1c1cc(CO)c(Cl)cn1
InChIInChI=1S/C12H17ClN2O/c1-9-4-2-3-5-15(9)12-6-10(8-16)11(13)7-14-12/h6-7,9,16H,2-5,8H2,1H3
InChIKeyCPQFYSIBPMPTJI-UHFFFAOYSA-N
XLogP2.61
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.73
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[5-chloro-2-(2-cyclopentylpyrrolidin-1-yl)-4-pyridinyl]methanol
CID 114920343
4-chloro-6-(2-methylpiperidin-1-yl)pyrimidine
CID 53410093
[2-(2-methylpiperidin-1-yl)quinolin-4-yl]methanol
CID 61253176
1-[5-chloro-4-(hydroxymethyl)-2-pyridinyl]piperidin-4-ol
CID 114920202
6-(2-methylpiperidin-1-yl)pyridine-3,4-diamine
CID 165447697
[4-chloro-2-(2-methylpiperidin-1-yl)phenyl]methanol
CID 114845110
[5-chloro-2-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)-4-pyridinyl]methanol
CID 114920185
[2-(3-tert-butylpyrrolidin-1-yl)-5-chloro-4-pyridinyl]methanol
CID 114920499
[5-chloro-2-[3-(dimethylamino)piperidin-1-yl]-4-pyridinyl]methanol
CID 114920435
5-methyl-2-(2-methylpiperidin-1-yl)pyridin-4-amine
CID 83265979
5-(chloromethyl)-2-(2-methylpiperidin-1-yl)pyridine
CID 61255734
[2-(8-azaspiro[4.5]decan-8-yl)-5-chloro-4-pyridinyl]methanol
CID 114920391

Frequently Asked Questions

What is the IUPAC name of [5-chloro-2-(2-methylpiperidin-1-yl)-4-pyridinyl]methanol?
The IUPAC name of [5-chloro-2-(2-methylpiperidin-1-yl)-4-pyridinyl]methanol (CID 114920177) is [5-chloro-2-(2-methylpiperidin-1-yl)-4-pyridinyl]methanol.
What is the SMILES notation for [5-chloro-2-(2-methylpiperidin-1-yl)-4-pyridinyl]methanol?
The canonical SMILES for [5-chloro-2-(2-methylpiperidin-1-yl)-4-pyridinyl]methanol is CC1CCCCN1c1cc(CO)c(Cl)cn1.
What is the InChIKey of [5-chloro-2-(2-methylpiperidin-1-yl)-4-pyridinyl]methanol?
The InChIKey is CPQFYSIBPMPTJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17ClN2O/c1-9-4-2-3-5-15(9)12-6-10(8-16)11(13)7-14-12/h6-7,9,16H,2-5,8H2,1H3.
What are the key properties of [5-chloro-2-(2-methylpiperidin-1-yl)-4-pyridinyl]methanol?
[5-chloro-2-(2-methylpiperidin-1-yl)-4-pyridinyl]methanol has a molecular weight of 240.73 g/mol, XLogP of 2.61, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-chloro-2-(2-methylpiperidin-1-yl)-4-pyridinyl]methanol is sourced from PubChem (CID 114920177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).