2-methyl-5-pyrrolidin-2-ylpyridine;dihydrochloride

C10H16Cl2N2 — CID 170920850

IUPAC2-methyl-5-pyrrolidin-2-ylpyridine;dihydrochloride
SMILESCc1ccc(C2CCCN2)cn1.Cl.Cl
InChIInChI=1S/C10H14N2.2ClH/c1-8-4-5-9(7-12-8)10-3-2-6-11-10;;/h4-5,7,10-11H,2-3,6H2,1H3;2*1H
InChIKeyIFAUMPRITKSKTR-UHFFFAOYSA-N
MW235.16 g/mol
LogP2.66
Rot. Bonds1

About 2-methyl-5-pyrrolidin-2-ylpyridine;dihydrochloride

2-methyl-5-pyrrolidin-2-ylpyridine;dihydrochloride (PubChem CID 170920850) has the molecular formula C10H16Cl2N2 and a molecular weight of 235.16 g/mol. Its IUPAC name is 2-methyl-5-pyrrolidin-2-ylpyridine;dihydrochloride.

Molecular Properties

Compound Name2-methyl-5-pyrrolidin-2-ylpyridine;dihydrochloride
PubChem CID170920850
Molecular FormulaC10H16Cl2N2
Molecular Weight235.16 g/mol
Exact Mass234.07
IUPAC Name2-methyl-5-pyrrolidin-2-ylpyridine;dihydrochloride
SMILESCc1ccc(C2CCCN2)cn1.Cl.Cl
InChIInChI=1S/C10H14N2.2ClH/c1-8-4-5-9(7-12-8)10-3-2-6-11-10;;/h4-5,7,10-11H,2-3,6H2,1H3;2*1H
InChIKeyIFAUMPRITKSKTR-UHFFFAOYSA-N
XLogP2.66
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.16
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-(aziridin-2-yl)-2-methylpyridine
CID 129016898
2-methyl-4-pyrrolidin-2-ylpyridine;dihydrochloride
CID 155487324
(2R)-2-(4-methylphenyl)pyrrolidine
CID 7047871
N,N-dimethyl-5-[(2S)-pyrrolidin-2-yl]pyridin-2-amine
CID 95732568
3-methyl-7-piperidin-2-ylisoquinoline
CID 117325813
(2R)-2-[4-(4-methylphenyl)phenyl]pyrrolidine
CID 66519668
2-chloro-5-[(2S)-piperidin-2-yl]pyridine;dihydrochloride
CID 164890613
2-chloro-5-[(2S)-piperidin-2-yl]pyridine;hydrochloride
CID 171194804
5-[(2R)-pyrrolidin-2-yl]-2-(trifluoromethyl)pyridine
CID 97289984
5-[(2S)-pyrrolidin-2-yl]pyridine-2-carbonitrile
CID 55274675
5-[(2S)-4,4-difluoropiperidin-2-yl]-2-methylpyridine
CID 167033139
4-[(2R)-pyrrolidin-2-yl]pyridine;hydrochloride
CID 171195835

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-pyrrolidin-2-ylpyridine;dihydrochloride?
The IUPAC name of 2-methyl-5-pyrrolidin-2-ylpyridine;dihydrochloride (CID 170920850) is 2-methyl-5-pyrrolidin-2-ylpyridine;dihydrochloride.
What is the SMILES notation for 2-methyl-5-pyrrolidin-2-ylpyridine;dihydrochloride?
The canonical SMILES for 2-methyl-5-pyrrolidin-2-ylpyridine;dihydrochloride is Cc1ccc(C2CCCN2)cn1.Cl.Cl.
What is the InChIKey of 2-methyl-5-pyrrolidin-2-ylpyridine;dihydrochloride?
The InChIKey is IFAUMPRITKSKTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2.2ClH/c1-8-4-5-9(7-12-8)10-3-2-6-11-10;;/h4-5,7,10-11H,2-3,6H2,1H3;2*1H.
What are the key properties of 2-methyl-5-pyrrolidin-2-ylpyridine;dihydrochloride?
2-methyl-5-pyrrolidin-2-ylpyridine;dihydrochloride has a molecular weight of 235.16 g/mol, XLogP of 2.66, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-pyrrolidin-2-ylpyridine;dihydrochloride is sourced from PubChem (CID 170920850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).