(4-pyrrolidin-1-yl-2-pyridinyl)methanol

C10H14N2O — CID 61253003

IUPAC(4-pyrrolidin-1-yl-2-pyridinyl)methanol
SMILESOCc1cc(N2CCCC2)ccn1
InChIInChI=1S/C10H14N2O/c13-8-9-7-10(3-4-11-9)12-5-1-2-6-12/h3-4,7,13H,1-2,5-6,8H2
InChIKeyJJUYJXYQSYJRER-UHFFFAOYSA-N
MW178.23 g/mol
LogP1.17
Rot. Bonds2

About (4-pyrrolidin-1-yl-2-pyridinyl)methanol

(4-pyrrolidin-1-yl-2-pyridinyl)methanol (PubChem CID 61253003) has the molecular formula C10H14N2O and a molecular weight of 178.23 g/mol. Its IUPAC name is (4-pyrrolidin-1-yl-2-pyridinyl)methanol.

Molecular Properties

Compound Name(4-pyrrolidin-1-yl-2-pyridinyl)methanol
PubChem CID61253003
Molecular FormulaC10H14N2O
Molecular Weight178.23 g/mol
Exact Mass178.11
IUPAC Name(4-pyrrolidin-1-yl-2-pyridinyl)methanol
SMILESOCc1cc(N2CCCC2)ccn1
InChIInChI=1S/C10H14N2O/c13-8-9-7-10(3-4-11-9)12-5-1-2-6-12/h3-4,7,13H,1-2,5-6,8H2
InChIKeyJJUYJXYQSYJRER-UHFFFAOYSA-N
XLogP1.17
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.23
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (4-pyrrolidin-1-yl-2-pyridinyl)methanol?
The IUPAC name of (4-pyrrolidin-1-yl-2-pyridinyl)methanol (CID 61253003) is (4-pyrrolidin-1-yl-2-pyridinyl)methanol.
What is the SMILES notation for (4-pyrrolidin-1-yl-2-pyridinyl)methanol?
The canonical SMILES for (4-pyrrolidin-1-yl-2-pyridinyl)methanol is OCc1cc(N2CCCC2)ccn1.
What is the InChIKey of (4-pyrrolidin-1-yl-2-pyridinyl)methanol?
The InChIKey is JJUYJXYQSYJRER-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O/c13-8-9-7-10(3-4-11-9)12-5-1-2-6-12/h3-4,7,13H,1-2,5-6,8H2.
What are the key properties of (4-pyrrolidin-1-yl-2-pyridinyl)methanol?
(4-pyrrolidin-1-yl-2-pyridinyl)methanol has a molecular weight of 178.23 g/mol, XLogP of 1.17, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-pyrrolidin-1-yl-2-pyridinyl)methanol is sourced from PubChem (CID 61253003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).