pyridin-3-yl(pyrrolidin-2-yl)methanol

C10H14N2O — CID 22605701

IUPACpyridin-3-yl(pyrrolidin-2-yl)methanol
SMILESOC(c1cccnc1)C1CCCN1
InChIInChI=1S/C10H14N2O/c13-10(9-4-2-6-12-9)8-3-1-5-11-7-8/h1,3,5,7,9-10,12-13H,2,4,6H2
InChIKeySLUWZQLWSNLZMU-UHFFFAOYSA-N
MW178.24 g/mol
LogP0.87
Rot. Bonds2

About pyridin-3-yl(pyrrolidin-2-yl)methanol

pyridin-3-yl(pyrrolidin-2-yl)methanol (PubChem CID 22605701) has the molecular formula C10H14N2O and a molecular weight of 178.24 g/mol. Its IUPAC name is pyridin-3-yl(pyrrolidin-2-yl)methanol.

Molecular Properties

Compound Namepyridin-3-yl(pyrrolidin-2-yl)methanol
PubChem CID22605701
Molecular FormulaC10H14N2O
Molecular Weight178.24 g/mol
Exact Mass178.11
IUPAC Namepyridin-3-yl(pyrrolidin-2-yl)methanol
SMILESOC(c1cccnc1)C1CCCN1
InChIInChI=1S/C10H14N2O/c13-10(9-4-2-6-12-9)8-3-1-5-11-7-8/h1,3,5,7,9-10,12-13H,2,4,6H2
InChIKeySLUWZQLWSNLZMU-UHFFFAOYSA-N
XLogP0.87
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.24
LogP ≤ 50.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

phenyl-[(2R)-pyrrolidin-2-yl]methanol;hydrochloride
CID 68687169
2,3-dihydro-1H-indol-2-yl(pyridin-3-yl)methanol
CID 65042396
3-[hydroxy(pyrrolidin-2-yl)methyl]phenol
CID 83484257
2,2-diphenyl-1-[(2R)-pyrrolidin-2-yl]ethanol
CID 118229705
2,2-diphenyl-1-pyrrolidin-2-ylethanol
CID 69294076
(S)-(4-methylphenyl)-[(2R)-pyrrolidin-2-yl]methanol
CID 39238470
2,2-diphenyl-1-[(2S)-pyrrolidin-2-yl]ethanol
CID 68647594
(2-amino-3-pyridinyl)-[(2R)-pyrrolidin-2-yl]methanol
CID 164654106
ethane;(3-fluorophenyl)-[(2S)-pyrrolidin-2-yl]methanol
CID 142546484
(2-amino-3-pyridinyl)-pyrrolidin-2-ylmethanol
CID 106639861
ethane;(4-methylphenyl)-pyrrolidin-2-ylmethanol
CID 142507494
(5-propan-2-yloxy-3-pyridinyl)-pyrrolidin-2-ylmethanol
CID 106639944

Frequently Asked Questions

What is the IUPAC name of pyridin-3-yl(pyrrolidin-2-yl)methanol?
The IUPAC name of pyridin-3-yl(pyrrolidin-2-yl)methanol (CID 22605701) is pyridin-3-yl(pyrrolidin-2-yl)methanol.
What is the SMILES notation for pyridin-3-yl(pyrrolidin-2-yl)methanol?
The canonical SMILES for pyridin-3-yl(pyrrolidin-2-yl)methanol is OC(c1cccnc1)C1CCCN1.
What is the InChIKey of pyridin-3-yl(pyrrolidin-2-yl)methanol?
The InChIKey is SLUWZQLWSNLZMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O/c13-10(9-4-2-6-12-9)8-3-1-5-11-7-8/h1,3,5,7,9-10,12-13H,2,4,6H2.
What are the key properties of pyridin-3-yl(pyrrolidin-2-yl)methanol?
pyridin-3-yl(pyrrolidin-2-yl)methanol has a molecular weight of 178.24 g/mol, XLogP of 0.87, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for pyridin-3-yl(pyrrolidin-2-yl)methanol is sourced from PubChem (CID 22605701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).