2-(pyrrolidin-3-ylmethyl)pyridine;hydrochloride

C10H15ClN2 — CID 86262770

IUPAC2-(pyrrolidin-3-ylmethyl)pyridine;hydrochloride
SMILESCl.c1ccc(CC2CCNC2)nc1
InChIInChI=1S/C10H14N2.ClH/c1-2-5-12-10(3-1)7-9-4-6-11-8-9;/h1-3,5,9,11H,4,6-8H2;1H
InChIKeyCZYPPTUXSALRRN-UHFFFAOYSA-N
MW198.70 g/mol
LogP1.66
Rot. Bonds2

About 2-(pyrrolidin-3-ylmethyl)pyridine;hydrochloride

2-(pyrrolidin-3-ylmethyl)pyridine;hydrochloride (PubChem CID 86262770) has the molecular formula C10H15ClN2 and a molecular weight of 198.70 g/mol. Its IUPAC name is 2-(pyrrolidin-3-ylmethyl)pyridine;hydrochloride.

Molecular Properties

Compound Name2-(pyrrolidin-3-ylmethyl)pyridine;hydrochloride
PubChem CID86262770
Molecular FormulaC10H15ClN2
Molecular Weight198.70 g/mol
Exact Mass198.09
IUPAC Name2-(pyrrolidin-3-ylmethyl)pyridine;hydrochloride
SMILESCl.c1ccc(CC2CCNC2)nc1
InChIInChI=1S/C10H14N2.ClH/c1-2-5-12-10(3-1)7-9-4-6-11-8-9;/h1-3,5,9,11H,4,6-8H2;1H
InChIKeyCZYPPTUXSALRRN-UHFFFAOYSA-N
XLogP1.66
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.70
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-N-(pyridin-2-ylmethyl)-1-[(3R)-pyrrolidin-3-yl]methanamine
CID 94408610
2-[2-(pyrrolidin-3-ylmethoxy)ethyl]pyridine
CID 62371245
2-[[(S)-[(3S)-pyrrolidin-3-yl]methylsulfinyl]methyl]pyridine
CID 97166419
2-(cyclohexylmethyl)pyridine
CID 14762660
2-(pyrrolidin-3-ylmethoxy)pyridine
CID 62371943
4-tert-butyl-2-(pyrrolidin-3-ylmethyl)pyridine
CID 157238992
2-pyridin-2-yl-N-(2-pyrrolidin-3-ylethyl)acetamide
CID 63630243
5-cyclopropyl-2-[[(3S)-pyrrolidin-3-yl]methyl]pyridine
CID 158085877
2-[[(3S)-pyrrolidin-3-yl]methylsulfanyl]pyridine
CID 94408883
3-methoxy-2-[[(3R)-pyrrolidin-3-yl]methyl]pyridine
CID 153376724
2-(piperidin-3-ylmethylsulfanylmethyl)pyridine
CID 71637112
5-methoxy-2-[[(3R)-pyrrolidin-3-yl]methyl]pyridine
CID 146288202

Frequently Asked Questions

What is the IUPAC name of 2-(pyrrolidin-3-ylmethyl)pyridine;hydrochloride?
The IUPAC name of 2-(pyrrolidin-3-ylmethyl)pyridine;hydrochloride (CID 86262770) is 2-(pyrrolidin-3-ylmethyl)pyridine;hydrochloride.
What is the SMILES notation for 2-(pyrrolidin-3-ylmethyl)pyridine;hydrochloride?
The canonical SMILES for 2-(pyrrolidin-3-ylmethyl)pyridine;hydrochloride is Cl.c1ccc(CC2CCNC2)nc1.
What is the InChIKey of 2-(pyrrolidin-3-ylmethyl)pyridine;hydrochloride?
The InChIKey is CZYPPTUXSALRRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2.ClH/c1-2-5-12-10(3-1)7-9-4-6-11-8-9;/h1-3,5,9,11H,4,6-8H2;1H.
What are the key properties of 2-(pyrrolidin-3-ylmethyl)pyridine;hydrochloride?
2-(pyrrolidin-3-ylmethyl)pyridine;hydrochloride has a molecular weight of 198.70 g/mol, XLogP of 1.66, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(pyrrolidin-3-ylmethyl)pyridine;hydrochloride is sourced from PubChem (CID 86262770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).