5-piperidin-2-ylpyridine-2-carbonitrile

C11H13N3 — CID 55271438

IUPAC5-piperidin-2-ylpyridine-2-carbonitrile
SMILESN#Cc1ccc(C2CCCCN2)cn1
InChIInChI=1S/C11H13N3/c12-7-10-5-4-9(8-14-10)11-3-1-2-6-13-11/h4-5,8,11,13H,1-3,6H2
InChIKeySMNBSUIAPGKOCA-UHFFFAOYSA-N
MW187.25 g/mol
LogP1.77
Rot. Bonds1

About 5-piperidin-2-ylpyridine-2-carbonitrile

5-piperidin-2-ylpyridine-2-carbonitrile (PubChem CID 55271438) has the molecular formula C11H13N3 and a molecular weight of 187.25 g/mol. Its IUPAC name is 5-piperidin-2-ylpyridine-2-carbonitrile.

Molecular Properties

Compound Name5-piperidin-2-ylpyridine-2-carbonitrile
PubChem CID55271438
Molecular FormulaC11H13N3
Molecular Weight187.25 g/mol
Exact Mass187.11
IUPAC Name5-piperidin-2-ylpyridine-2-carbonitrile
SMILESN#Cc1ccc(C2CCCCN2)cn1
InChIInChI=1S/C11H13N3/c12-7-10-5-4-9(8-14-10)11-3-1-2-6-13-11/h4-5,8,11,13H,1-3,6H2
InChIKeySMNBSUIAPGKOCA-UHFFFAOYSA-N
XLogP1.77
TPSA48.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.25
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-[(2S)-pyrrolidin-2-yl]pyridine-2-carbonitrile
CID 55274675
2-fluoro-5-[(2S)-piperidin-2-yl]pyridine
CID 55277900
2-chloro-5-[(2S)-piperidin-2-yl]pyridine;dihydrochloride
CID 164890613
2-chloro-5-[(2S)-piperidin-2-yl]pyridine;hydrochloride
CID 171194804
4-[(2S)-piperidin-2-yl]pyridine-3-carbonitrile
CID 55263705
5-piperidin-2-ylpyrimidin-2-amine
CID 82409904
2-methoxy-5-piperidin-2-ylpyridine-3-carbonitrile
CID 115030168
N-cyclobutyl-5-piperidin-2-ylpyridin-2-amine
CID 102540393
4-[(2S)-piperidin-2-yl]pyridazine;hydrochloride
CID 138376376
2-pyridazin-4-ylazepane
CID 104670038
4-piperidin-2-ylphenol
CID 19711202
(2S)-2-(4-bromophenyl)piperidine
CID 7022866

Frequently Asked Questions

What is the IUPAC name of 5-piperidin-2-ylpyridine-2-carbonitrile?
The IUPAC name of 5-piperidin-2-ylpyridine-2-carbonitrile (CID 55271438) is 5-piperidin-2-ylpyridine-2-carbonitrile.
What is the SMILES notation for 5-piperidin-2-ylpyridine-2-carbonitrile?
The canonical SMILES for 5-piperidin-2-ylpyridine-2-carbonitrile is N#Cc1ccc(C2CCCCN2)cn1.
What is the InChIKey of 5-piperidin-2-ylpyridine-2-carbonitrile?
The InChIKey is SMNBSUIAPGKOCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3/c12-7-10-5-4-9(8-14-10)11-3-1-2-6-13-11/h4-5,8,11,13H,1-3,6H2.
What are the key properties of 5-piperidin-2-ylpyridine-2-carbonitrile?
5-piperidin-2-ylpyridine-2-carbonitrile has a molecular weight of 187.25 g/mol, XLogP of 1.77, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-piperidin-2-ylpyridine-2-carbonitrile is sourced from PubChem (CID 55271438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).