(3S)-1-(1,2-dihydropyridin-2-yl)piperidin-3-ol

C10H16N2O — CID 86340887

IUPAC(3S)-1-(1,2-dihydropyridin-2-yl)piperidin-3-ol
SMILESO[C@H]1CCCN(C2C=CC=CN2)C1
InChIInChI=1S/C10H16N2O/c13-9-4-3-7-12(8-9)10-5-1-2-6-11-10/h1-2,5-6,9-11,13H,3-4,7-8H2/t9-,10?/m0/s1
InChIKeyNYZPJAUMTYBMDJ-RGURZIINSA-N
MW180.25 g/mol
LogP0.44
Rot. Bonds1

About (3S)-1-(1,2-dihydropyridin-2-yl)piperidin-3-ol

(3S)-1-(1,2-dihydropyridin-2-yl)piperidin-3-ol (PubChem CID 86340887) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is (3S)-1-(1,2-dihydropyridin-2-yl)piperidin-3-ol.

Molecular Properties

Compound Name(3S)-1-(1,2-dihydropyridin-2-yl)piperidin-3-ol
PubChem CID86340887
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC Name(3S)-1-(1,2-dihydropyridin-2-yl)piperidin-3-ol
SMILESO[C@H]1CCCN(C2C=CC=CN2)C1
InChIInChI=1S/C10H16N2O/c13-9-4-3-7-12(8-9)10-5-1-2-6-11-10/h1-2,5-6,9-11,13H,3-4,7-8H2/t9-,10?/m0/s1
InChIKeyNYZPJAUMTYBMDJ-RGURZIINSA-N
XLogP0.44
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 50.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (3S)-1-(1,2-dihydropyridin-2-yl)piperidin-3-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-pyrrolidin-1-yl-1,2-dihydropyridine
CID 21071163
(5R)-9-(1,2-dihydropyridin-2-yl)-2-(4-hydroxycyclohexyl)-2,9-diazaspiro[4.5]decan-1-one
CID 173174944
(3R)-1-cyclooctylpiperidin-3-ol
CID 129493857
(3R)-1-[(3S)-2,2-dimethylpyrrolidin-3-yl]piperidin-3-ol
CID 100811160
(2R,8S,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizine-2,8-diol
CID 10820830
(5R)-9-(1,2-dihydropyridin-2-yl)-2-(oxan-4-yl)-2,9-diazaspiro[4.5]decan-1-one
CID 173174986
(3S)-3-[(3S)-3-hydroxypiperidin-1-yl]piperidin-2-one
CID 129349004
(3R)-3-[(3S)-3-hydroxypiperidin-1-yl]piperidin-2-one
CID 129349003
4-[(3S)-3-hydroxypiperidin-1-yl]cyclohexane-1-carboxylic acid
CID 129462245
2-(3-hydroxypiperidin-1-yl)cyclopentan-1-one
CID 62037163
1-(thian-3-yl)piperidin-3-ol
CID 83831950
2-(3-hydroxypiperidin-1-yl)cyclobutane-1-carboxylic acid
CID 80996172

Frequently Asked Questions

What is the IUPAC name of (3S)-1-(1,2-dihydropyridin-2-yl)piperidin-3-ol?
The IUPAC name of (3S)-1-(1,2-dihydropyridin-2-yl)piperidin-3-ol (CID 86340887) is (3S)-1-(1,2-dihydropyridin-2-yl)piperidin-3-ol.
What is the SMILES notation for (3S)-1-(1,2-dihydropyridin-2-yl)piperidin-3-ol?
The canonical SMILES for (3S)-1-(1,2-dihydropyridin-2-yl)piperidin-3-ol is O[C@H]1CCCN(C2C=CC=CN2)C1.
What is the InChIKey of (3S)-1-(1,2-dihydropyridin-2-yl)piperidin-3-ol?
The InChIKey is NYZPJAUMTYBMDJ-RGURZIINSA-N. The full InChI is InChI=1S/C10H16N2O/c13-9-4-3-7-12(8-9)10-5-1-2-6-11-10/h1-2,5-6,9-11,13H,3-4,7-8H2/t9-,10?/m0/s1.
What are the key properties of (3S)-1-(1,2-dihydropyridin-2-yl)piperidin-3-ol?
(3S)-1-(1,2-dihydropyridin-2-yl)piperidin-3-ol has a molecular weight of 180.25 g/mol, XLogP of 0.44, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-1-(1,2-dihydropyridin-2-yl)piperidin-3-ol is sourced from PubChem (CID 86340887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).