1-(5-chloro-2-pyridinyl)-3-methylpiperidin-3-ol

C11H15ClN2O — CID 115871312

IUPAC1-(5-chloro-2-pyridinyl)-3-methylpiperidin-3-ol
SMILESCC1(O)CCCN(c2ccc(Cl)cn2)C1
InChIInChI=1S/C11H15ClN2O/c1-11(15)5-2-6-14(8-11)10-4-3-9(12)7-13-10/h3-4,7,15H,2,5-6,8H2,1H3
InChIKeyAAHMXGJHRYWZQN-UHFFFAOYSA-N
MW226.71 g/mol
LogP2.09
Rot. Bonds1

About 1-(5-chloro-2-pyridinyl)-3-methylpiperidin-3-ol

1-(5-chloro-2-pyridinyl)-3-methylpiperidin-3-ol (PubChem CID 115871312) has the molecular formula C11H15ClN2O and a molecular weight of 226.71 g/mol. Its IUPAC name is 1-(5-chloro-2-pyridinyl)-3-methylpiperidin-3-ol.

Molecular Properties

Compound Name1-(5-chloro-2-pyridinyl)-3-methylpiperidin-3-ol
PubChem CID115871312
Molecular FormulaC11H15ClN2O
Molecular Weight226.71 g/mol
Exact Mass226.09
IUPAC Name1-(5-chloro-2-pyridinyl)-3-methylpiperidin-3-ol
SMILESCC1(O)CCCN(c2ccc(Cl)cn2)C1
InChIInChI=1S/C11H15ClN2O/c1-11(15)5-2-6-14(8-11)10-4-3-9(12)7-13-10/h3-4,7,15H,2,5-6,8H2,1H3
InChIKeyAAHMXGJHRYWZQN-UHFFFAOYSA-N
XLogP2.09
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.71
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[5-[(1R)-1-aminoethyl]-2-pyridinyl]-3-methylpiperidin-3-ol
CID 104876737
7-(5-chloro-2-pyridinyl)-2-methyl-2,7-diazaspiro[4.5]decane
CID 56749174
5-chloro-2-(4,4-dimethylpiperidin-1-yl)pyridine
CID 66233669
4-(5-chloro-2-pyridinyl)-1,2,2-trimethylpiperazine
CID 66233004
[1-(5-chloro-2-pyridinyl)-3-prop-2-enylpiperidin-3-yl]methanol
CID 72901356
6-(3-hydroxy-3-methylpyrrolidin-1-yl)pyridine-3-carboxylic acid
CID 103356410
8-(5-chloro-2-pyridinyl)-8-azaspiro[4.5]decane
CID 66233219
1'-(5-chloro-2-pyridinyl)-2-methylspiro[5,6-dihydrocyclopenta[d]pyrimidine-7,3'-piperidine]
CID 135110515
5-chloro-2-(3-hydroxy-3-methylpiperidin-1-yl)benzaldehyde
CID 114844580
1-(5-chloro-3-fluoro-2-pyridinyl)-3-methylpyrrolidin-3-ol
CID 103738622
4-chloro-2-(3-hydroxy-3-methylpiperidin-1-yl)benzaldehyde
CID 114844581
(3R)-1-(5-chloro-2-pyridinyl)-3-(2-phenoxyethyl)piperidine-3-carboxylic acid
CID 95556205

Frequently Asked Questions

What is the IUPAC name of 1-(5-chloro-2-pyridinyl)-3-methylpiperidin-3-ol?
The IUPAC name of 1-(5-chloro-2-pyridinyl)-3-methylpiperidin-3-ol (CID 115871312) is 1-(5-chloro-2-pyridinyl)-3-methylpiperidin-3-ol.
What is the SMILES notation for 1-(5-chloro-2-pyridinyl)-3-methylpiperidin-3-ol?
The canonical SMILES for 1-(5-chloro-2-pyridinyl)-3-methylpiperidin-3-ol is CC1(O)CCCN(c2ccc(Cl)cn2)C1.
What is the InChIKey of 1-(5-chloro-2-pyridinyl)-3-methylpiperidin-3-ol?
The InChIKey is AAHMXGJHRYWZQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClN2O/c1-11(15)5-2-6-14(8-11)10-4-3-9(12)7-13-10/h3-4,7,15H,2,5-6,8H2,1H3.
What are the key properties of 1-(5-chloro-2-pyridinyl)-3-methylpiperidin-3-ol?
1-(5-chloro-2-pyridinyl)-3-methylpiperidin-3-ol has a molecular weight of 226.71 g/mol, XLogP of 2.09, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-chloro-2-pyridinyl)-3-methylpiperidin-3-ol is sourced from PubChem (CID 115871312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).