5-[(2S)-pyrrolidin-2-yl]pyridine-2-carbonitrile

C10H11N3 — CID 55274675

IUPAC5-[(2S)-pyrrolidin-2-yl]pyridine-2-carbonitrile
SMILESN#Cc1ccc([C@@H]2CCCN2)cn1
InChIInChI=1S/C10H11N3/c11-6-9-4-3-8(7-13-9)10-2-1-5-12-10/h3-4,7,10,12H,1-2,5H2/t10-/m0/s1
InChIKeySRTGBZLPXOKAQC-JTQLQIEISA-N
MW173.22 g/mol
LogP1.38
Rot. Bonds1

About 5-[(2S)-pyrrolidin-2-yl]pyridine-2-carbonitrile

5-[(2S)-pyrrolidin-2-yl]pyridine-2-carbonitrile (PubChem CID 55274675) has the molecular formula C10H11N3 and a molecular weight of 173.22 g/mol. Its IUPAC name is 5-[(2S)-pyrrolidin-2-yl]pyridine-2-carbonitrile.

Molecular Properties

Compound Name5-[(2S)-pyrrolidin-2-yl]pyridine-2-carbonitrile
PubChem CID55274675
Molecular FormulaC10H11N3
Molecular Weight173.22 g/mol
Exact Mass173.10
IUPAC Name5-[(2S)-pyrrolidin-2-yl]pyridine-2-carbonitrile
SMILESN#Cc1ccc([C@@H]2CCCN2)cn1
InChIInChI=1S/C10H11N3/c11-6-9-4-3-8(7-13-9)10-2-1-5-12-10/h3-4,7,10,12H,1-2,5H2/t10-/m0/s1
InChIKeySRTGBZLPXOKAQC-JTQLQIEISA-N
XLogP1.38
TPSA48.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.22
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-piperidin-2-ylpyridine-2-carbonitrile
CID 55271438
2-methyl-5-pyrrolidin-2-ylpyridine;dihydrochloride
CID 170920850
2-methyl-4-[(2S)-pyrrolidin-2-yl]benzonitrile
CID 66518349
N,N-dimethyl-5-[(2S)-pyrrolidin-2-yl]pyridin-2-amine
CID 95732568
5-[(2R)-pyrrolidin-2-yl]-2-(trifluoromethyl)pyridine
CID 97289984
2-hydroxy-5-pyrrolidin-2-ylbenzonitrile
CID 77131425
4-pyrrolidin-2-ylpyridine-3-carbonitrile
CID 82411637
2-fluoro-5-[(2S)-piperidin-2-yl]pyridine
CID 55277900
5-pyrrolidin-2-ylpyridine-2-carboxylic acid
CID 55296830
5-[ethyl(pyrrolidin-2-ylmethyl)amino]pyridine-2-carbonitrile
CID 106619532
5-[cyclopropylmethyl(pyrrolidin-2-ylmethyl)amino]pyridine-2-carbonitrile
CID 106620212
5-(7-azabicyclo[2.2.1]heptan-2-yl)pyridine-2-carbonitrile
CID 89127055

Frequently Asked Questions

What is the IUPAC name of 5-[(2S)-pyrrolidin-2-yl]pyridine-2-carbonitrile?
The IUPAC name of 5-[(2S)-pyrrolidin-2-yl]pyridine-2-carbonitrile (CID 55274675) is 5-[(2S)-pyrrolidin-2-yl]pyridine-2-carbonitrile.
What is the SMILES notation for 5-[(2S)-pyrrolidin-2-yl]pyridine-2-carbonitrile?
The canonical SMILES for 5-[(2S)-pyrrolidin-2-yl]pyridine-2-carbonitrile is N#Cc1ccc([C@@H]2CCCN2)cn1.
What is the InChIKey of 5-[(2S)-pyrrolidin-2-yl]pyridine-2-carbonitrile?
The InChIKey is SRTGBZLPXOKAQC-JTQLQIEISA-N. The full InChI is InChI=1S/C10H11N3/c11-6-9-4-3-8(7-13-9)10-2-1-5-12-10/h3-4,7,10,12H,1-2,5H2/t10-/m0/s1.
What are the key properties of 5-[(2S)-pyrrolidin-2-yl]pyridine-2-carbonitrile?
5-[(2S)-pyrrolidin-2-yl]pyridine-2-carbonitrile has a molecular weight of 173.22 g/mol, XLogP of 1.38, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2S)-pyrrolidin-2-yl]pyridine-2-carbonitrile is sourced from PubChem (CID 55274675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).