3-chloro-5-(1-methylpyrrolidin-2-yl)pyridine

C10H13ClN2 — CID 19421759

IUPAC3-chloro-5-(1-methylpyrrolidin-2-yl)pyridine
SMILESCN1CCCC1c1cncc(Cl)c1
InChIInChI=1S/C10H13ClN2/c1-13-4-2-3-10(13)8-5-9(11)7-12-6-8/h5-7,10H,2-4H2,1H3
InChIKeyOEYGFNDZWDFDLU-UHFFFAOYSA-N
MW196.68 g/mol
LogP2.50
Rot. Bonds1

About 3-chloro-5-(1-methylpyrrolidin-2-yl)pyridine

3-chloro-5-(1-methylpyrrolidin-2-yl)pyridine (PubChem CID 19421759) has the molecular formula C10H13ClN2 and a molecular weight of 196.68 g/mol. Its IUPAC name is 3-chloro-5-(1-methylpyrrolidin-2-yl)pyridine.

Molecular Properties

Compound Name3-chloro-5-(1-methylpyrrolidin-2-yl)pyridine
PubChem CID19421759
Molecular FormulaC10H13ClN2
Molecular Weight196.68 g/mol
Exact Mass196.08
IUPAC Name3-chloro-5-(1-methylpyrrolidin-2-yl)pyridine
SMILESCN1CCCC1c1cncc(Cl)c1
InChIInChI=1S/C10H13ClN2/c1-13-4-2-3-10(13)8-5-9(11)7-12-6-8/h5-7,10H,2-4H2,1H3
InChIKeyOEYGFNDZWDFDLU-UHFFFAOYSA-N
XLogP2.50
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.68
LogP ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-chloro-5-(1-methylpyrrolidin-2-yl)pyridine?
The IUPAC name of 3-chloro-5-(1-methylpyrrolidin-2-yl)pyridine (CID 19421759) is 3-chloro-5-(1-methylpyrrolidin-2-yl)pyridine.
What is the SMILES notation for 3-chloro-5-(1-methylpyrrolidin-2-yl)pyridine?
The canonical SMILES for 3-chloro-5-(1-methylpyrrolidin-2-yl)pyridine is CN1CCCC1c1cncc(Cl)c1.
What is the InChIKey of 3-chloro-5-(1-methylpyrrolidin-2-yl)pyridine?
The InChIKey is OEYGFNDZWDFDLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13ClN2/c1-13-4-2-3-10(13)8-5-9(11)7-12-6-8/h5-7,10H,2-4H2,1H3.
What are the key properties of 3-chloro-5-(1-methylpyrrolidin-2-yl)pyridine?
3-chloro-5-(1-methylpyrrolidin-2-yl)pyridine has a molecular weight of 196.68 g/mol, XLogP of 2.50, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-5-(1-methylpyrrolidin-2-yl)pyridine is sourced from PubChem (CID 19421759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).