2-[1-[(2S)-1-methylpyrrolidin-2-yl]ethyl]pyridin-3-ol;hydrochloride

C12H19ClN2O — CID 67585183

IUPAC2-[1-[(2S)-1-methylpyrrolidin-2-yl]ethyl]pyridin-3-ol;hydrochloride
SMILESCC(c1ncccc1O)[C@@H]1CCCN1C.Cl
InChIInChI=1S/C12H18N2O.ClH/c1-9(10-5-4-8-14(10)2)12-11(15)6-3-7-13-12;/h3,6-7,9-10,15H,4-5,8H2,1-2H3;1H/t9?,10-;/m0./s1
InChIKeySFMXMQMSOUMKHN-FTCYEJDNSA-N
MW242.75 g/mol
LogP2.41
Rot. Bonds2

About 2-[1-[(2S)-1-methylpyrrolidin-2-yl]ethyl]pyridin-3-ol;hydrochloride

2-[1-[(2S)-1-methylpyrrolidin-2-yl]ethyl]pyridin-3-ol;hydrochloride (PubChem CID 67585183) has the molecular formula C12H19ClN2O and a molecular weight of 242.75 g/mol. Its IUPAC name is 2-[1-[(2S)-1-methylpyrrolidin-2-yl]ethyl]pyridin-3-ol;hydrochloride.

Molecular Properties

Compound Name2-[1-[(2S)-1-methylpyrrolidin-2-yl]ethyl]pyridin-3-ol;hydrochloride
PubChem CID67585183
Molecular FormulaC12H19ClN2O
Molecular Weight242.75 g/mol
Exact Mass242.12
IUPAC Name2-[1-[(2S)-1-methylpyrrolidin-2-yl]ethyl]pyridin-3-ol;hydrochloride
SMILESCC(c1ncccc1O)[C@@H]1CCCN1C.Cl
InChIInChI=1S/C12H18N2O.ClH/c1-9(10-5-4-8-14(10)2)12-11(15)6-3-7-13-12;/h3,6-7,9-10,15H,4-5,8H2,1-2H3;1H/t9?,10-;/m0./s1
InChIKeySFMXMQMSOUMKHN-FTCYEJDNSA-N
XLogP2.41
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.75
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[1-[(2S)-1-methylpyrrolidin-2-yl]ethyl]pyridin-3-ol;hydrochloride 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-[1-[(2S)-2-methylpyrrolidin-1-yl]ethyl]pyridin-3-ol
CID 148926259
2-benzhydryl-1-methylpyrrolidine
CID 71178925
2-[(1S)-1-aminoethyl]pyridin-3-ol
CID 96848333
2-(1-bromoethyl)pyridin-3-ol
CID 174581885
(1R)-1-[(2R)-1-methylpyrrolidin-2-yl]ethanol
CID 155904197
(1R)-2-methyl-1-[(2S)-1-methylpyrrolidin-2-yl]-2-phenylpropan-1-ol
CID 170366184
4-[[3-(difluoromethyl)-2-pyridinyl]oxy]-3,3-dimethyl-2-(1-methylpyrrolidin-2-yl)butanamide
CID 175839929
2-(1-methylpyrrolidin-2-yl)pyrimidine
CID 89060530
2-hydroxypropanoic acid;2-methyl-3-[(2S)-1-methylpyrrolidin-2-yl]pyridine
CID 174226141
(2R)-N-[1-[(3-methyl-2-pyridinyl)oxymethyl]cyclopropyl]-2-[(2R)-1-methylpyrrolidin-2-yl]propanamide
CID 156875505
3-hydroxy-N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]pyridine-2-carboxamide
CID 79319888
N-(2-isoquinolin-1-ylpropan-2-yl)-2-(1-methylpyrrolidin-2-yl)propanamide
CID 166772582

Frequently Asked Questions

What is the IUPAC name of 2-[1-[(2S)-1-methylpyrrolidin-2-yl]ethyl]pyridin-3-ol;hydrochloride?
The IUPAC name of 2-[1-[(2S)-1-methylpyrrolidin-2-yl]ethyl]pyridin-3-ol;hydrochloride (CID 67585183) is 2-[1-[(2S)-1-methylpyrrolidin-2-yl]ethyl]pyridin-3-ol;hydrochloride.
What is the SMILES notation for 2-[1-[(2S)-1-methylpyrrolidin-2-yl]ethyl]pyridin-3-ol;hydrochloride?
The canonical SMILES for 2-[1-[(2S)-1-methylpyrrolidin-2-yl]ethyl]pyridin-3-ol;hydrochloride is CC(c1ncccc1O)[C@@H]1CCCN1C.Cl.
What is the InChIKey of 2-[1-[(2S)-1-methylpyrrolidin-2-yl]ethyl]pyridin-3-ol;hydrochloride?
The InChIKey is SFMXMQMSOUMKHN-FTCYEJDNSA-N. The full InChI is InChI=1S/C12H18N2O.ClH/c1-9(10-5-4-8-14(10)2)12-11(15)6-3-7-13-12;/h3,6-7,9-10,15H,4-5,8H2,1-2H3;1H/t9?,10-;/m0./s1.
What are the key properties of 2-[1-[(2S)-1-methylpyrrolidin-2-yl]ethyl]pyridin-3-ol;hydrochloride?
2-[1-[(2S)-1-methylpyrrolidin-2-yl]ethyl]pyridin-3-ol;hydrochloride has a molecular weight of 242.75 g/mol, XLogP of 2.41, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[(2S)-1-methylpyrrolidin-2-yl]ethyl]pyridin-3-ol;hydrochloride is sourced from PubChem (CID 67585183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).