3-methyl-5-[(3S)-pyrrolidin-3-yl]pyridine

C10H14N2 — CID 96736316

IUPAC3-methyl-5-[(3S)-pyrrolidin-3-yl]pyridine
SMILESCc1cncc([C@@H]2CCNC2)c1
InChIInChI=1S/C10H14N2/c1-8-4-10(7-12-5-8)9-2-3-11-6-9/h4-5,7,9,11H,2-3,6H2,1H3/t9-/m1/s1
InChIKeyCHIVLCXQRUOOEV-SECBINFHSA-N
MW162.24 g/mol
LogP1.47
Rot. Bonds1

About 3-methyl-5-[(3S)-pyrrolidin-3-yl]pyridine

3-methyl-5-[(3S)-pyrrolidin-3-yl]pyridine (PubChem CID 96736316) has the molecular formula C10H14N2 and a molecular weight of 162.24 g/mol. Its IUPAC name is 3-methyl-5-[(3S)-pyrrolidin-3-yl]pyridine.

Molecular Properties

Compound Name3-methyl-5-[(3S)-pyrrolidin-3-yl]pyridine
PubChem CID96736316
Molecular FormulaC10H14N2
Molecular Weight162.24 g/mol
Exact Mass162.12
IUPAC Name3-methyl-5-[(3S)-pyrrolidin-3-yl]pyridine
SMILESCc1cncc([C@@H]2CCNC2)c1
InChIInChI=1S/C10H14N2/c1-8-4-10(7-12-5-8)9-2-3-11-6-9/h4-5,7,9,11H,2-3,6H2,1H3/t9-/m1/s1
InChIKeyCHIVLCXQRUOOEV-SECBINFHSA-N
XLogP1.47
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.24
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(azetidin-3-yl)-5-methylpyridine;hydrochloride
CID 154791506
3-methyl-5-(3-methylpiperidin-4-yl)pyridine
CID 114502148
5-pyrrolidin-3-ylpyrimidine
CID 66996535
3-pyrrolidin-3-yl-5-(trifluoromethyl)pyridine
CID 71250619
3-methyl-5-[(2R)-piperidin-2-yl]pyridine
CID 96741558
3-pyrrolidin-3-ylpyridine
CID 3613651
3-[(5-methyl-3-pyridinyl)methyl]piperidin-4-ol
CID 102878520
CID 156632351
CID 156632351
3-[4-(3,5-dimethylphenyl)phenyl]pyrrolidine
CID 82297925
4-(5-methoxy-3-pyridinyl)azepane
CID 83261496
3-bromo-5-methyl-4-pyrrolidin-3-ylpyridine
CID 84702437
3-(4-methyl-1,3-dioxetan-2-yl)-5-piperidin-4-ylpyridine
CID 70903501

Frequently Asked Questions

What is the IUPAC name of 3-methyl-5-[(3S)-pyrrolidin-3-yl]pyridine?
The IUPAC name of 3-methyl-5-[(3S)-pyrrolidin-3-yl]pyridine (CID 96736316) is 3-methyl-5-[(3S)-pyrrolidin-3-yl]pyridine.
What is the SMILES notation for 3-methyl-5-[(3S)-pyrrolidin-3-yl]pyridine?
The canonical SMILES for 3-methyl-5-[(3S)-pyrrolidin-3-yl]pyridine is Cc1cncc([C@@H]2CCNC2)c1.
What is the InChIKey of 3-methyl-5-[(3S)-pyrrolidin-3-yl]pyridine?
The InChIKey is CHIVLCXQRUOOEV-SECBINFHSA-N. The full InChI is InChI=1S/C10H14N2/c1-8-4-10(7-12-5-8)9-2-3-11-6-9/h4-5,7,9,11H,2-3,6H2,1H3/t9-/m1/s1.
What are the key properties of 3-methyl-5-[(3S)-pyrrolidin-3-yl]pyridine?
3-methyl-5-[(3S)-pyrrolidin-3-yl]pyridine has a molecular weight of 162.24 g/mol, XLogP of 1.47, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-5-[(3S)-pyrrolidin-3-yl]pyridine is sourced from PubChem (CID 96736316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).