5-chloro-2-(pyrrolidin-2-ylmethyl)pyridine

C10H13ClN2 — CID 82657762

IUPAC5-chloro-2-(pyrrolidin-2-ylmethyl)pyridine
SMILESClc1ccc(CC2CCCN2)nc1
InChIInChI=1S/C10H13ClN2/c11-8-3-4-10(13-7-8)6-9-2-1-5-12-9/h3-4,7,9,12H,1-2,5-6H2
InChIKeyKOCUVHSYFJXMLY-UHFFFAOYSA-N
MW196.68 g/mol
LogP2.03
Rot. Bonds2

About 5-chloro-2-(pyrrolidin-2-ylmethyl)pyridine

5-chloro-2-(pyrrolidin-2-ylmethyl)pyridine (PubChem CID 82657762) has the molecular formula C10H13ClN2 and a molecular weight of 196.68 g/mol. Its IUPAC name is 5-chloro-2-(pyrrolidin-2-ylmethyl)pyridine.

Molecular Properties

Compound Name5-chloro-2-(pyrrolidin-2-ylmethyl)pyridine
PubChem CID82657762
Molecular FormulaC10H13ClN2
Molecular Weight196.68 g/mol
Exact Mass196.08
IUPAC Name5-chloro-2-(pyrrolidin-2-ylmethyl)pyridine
SMILESClc1ccc(CC2CCCN2)nc1
InChIInChI=1S/C10H13ClN2/c11-8-3-4-10(13-7-8)6-9-2-1-5-12-9/h3-4,7,9,12H,1-2,5-6H2
InChIKeyKOCUVHSYFJXMLY-UHFFFAOYSA-N
XLogP2.03
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.68
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(pyrrolidin-2-ylmethyl)pyrimidine
CID 82596500
5-(4-chlorophenyl)-2-(pyrrolidin-2-ylmethyl)-1H-imidazole
CID 61366673
5-chloro-3-(pyrrolidin-2-ylmethyl)-1,2-oxazole
CID 84719045
3-chloro-5-(pyrrolidin-2-ylmethyl)pyridine
CID 115008960
3-(pyrrolidin-2-ylmethyl)-1,2-oxazole
CID 82595027
2-[(5-chloro-2-cyclobutyloxyphenyl)methyl]pyrrolidine
CID 117418732
2-[(5-chloro-2-fluorophenoxy)methyl]pyrrolidine
CID 84693117
(2S)-2-[(3-chlorophenyl)methyl]pyrrolidine
CID 7022802
5-chloro-N-ethyl-N-(pyrrolidin-2-ylmethyl)pyridine-2-carboxamide
CID 106609136
5-chloro-N-cyclopropyl-N-(piperidin-2-ylmethyl)pyridine-2-carboxamide
CID 106626904
5-(4-chlorophenyl)-2-[2-[4-[[(2S)-pyrrolidin-2-yl]methyl]phenyl]ethynyl]pyridine
CID 173162861
5-(2-chlorophenyl)-2-(pyrrolidin-2-ylmethyl)-1H-imidazole
CID 61365687

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-(pyrrolidin-2-ylmethyl)pyridine?
The IUPAC name of 5-chloro-2-(pyrrolidin-2-ylmethyl)pyridine (CID 82657762) is 5-chloro-2-(pyrrolidin-2-ylmethyl)pyridine.
What is the SMILES notation for 5-chloro-2-(pyrrolidin-2-ylmethyl)pyridine?
The canonical SMILES for 5-chloro-2-(pyrrolidin-2-ylmethyl)pyridine is Clc1ccc(CC2CCCN2)nc1.
What is the InChIKey of 5-chloro-2-(pyrrolidin-2-ylmethyl)pyridine?
The InChIKey is KOCUVHSYFJXMLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13ClN2/c11-8-3-4-10(13-7-8)6-9-2-1-5-12-9/h3-4,7,9,12H,1-2,5-6H2.
What are the key properties of 5-chloro-2-(pyrrolidin-2-ylmethyl)pyridine?
5-chloro-2-(pyrrolidin-2-ylmethyl)pyridine has a molecular weight of 196.68 g/mol, XLogP of 2.03, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-(pyrrolidin-2-ylmethyl)pyridine is sourced from PubChem (CID 82657762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).