2-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]pyridine-3-carbonitrile

C14H17N5O — CID 47079116

IUPAC2-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]pyridine-3-carbonitrile
SMILESN#Cc1cccnc1N1CCCC(N2CCNC2=O)C1
InChIInChI=1S/C14H17N5O/c15-9-11-3-1-5-16-13(11)18-7-2-4-12(10-18)19-8-6-17-14(19)20/h1,3,5,12H,2,4,6-8,10H2,(H,17,20)
InChIKeyZGNCAEWEFBNZRZ-UHFFFAOYSA-N
MW271.32 g/mol
LogP0.95
Rot. Bonds2

About 2-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]pyridine-3-carbonitrile

2-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]pyridine-3-carbonitrile (PubChem CID 47079116) has the molecular formula C14H17N5O and a molecular weight of 271.32 g/mol. Its IUPAC name is 2-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]pyridine-3-carbonitrile.

Molecular Properties

Compound Name2-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]pyridine-3-carbonitrile
PubChem CID47079116
Molecular FormulaC14H17N5O
Molecular Weight271.32 g/mol
Exact Mass271.14
IUPAC Name2-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]pyridine-3-carbonitrile
SMILESN#Cc1cccnc1N1CCCC(N2CCNC2=O)C1
InChIInChI=1S/C14H17N5O/c15-9-11-3-1-5-16-13(11)18-7-2-4-12(10-18)19-8-6-17-14(19)20/h1,3,5,12H,2,4,6-8,10H2,(H,17,20)
InChIKeyZGNCAEWEFBNZRZ-UHFFFAOYSA-N
XLogP0.95
TPSA72.26 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-chloro-2-[(3R)-3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]benzonitrile
CID 96547785
5,6-dimethyl-3-[(3R)-3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]pyridazine-4-carbonitrile
CID 95590461
2-(3-piperazin-1-ylazetidin-1-yl)pyridine-3-carbonitrile
CID 66195251
2-[3-(5-oxo-4-phenyl-1H-1,2,4-triazol-3-yl)piperidin-1-yl]pyridine-3-carbonitrile
CID 56869965
2-[3-(methoxymethyl)piperidin-1-yl]pyridine-3-carbonitrile
CID 113235312
2-[(3S)-3-methylpiperazin-1-yl]pyridine-3-carbonitrile
CID 58826334
2-(4-methylazepan-1-yl)pyridine-3-carbonitrile
CID 55210322
2-[(3R)-3-morpholin-4-ylsulfonylpiperidin-1-yl]pyridine-3-carbonitrile
CID 97344026
2-(3-azabicyclo[4.1.0]heptan-3-yl)pyridine-3-carbonitrile
CID 117045417
2-[(3R)-3-[2-(methoxymethyl)pyrimidin-4-yl]piperidin-1-yl]pyridine-3-carbonitrile
CID 97063214
2-[3-(piperidine-1-carbonyl)pyrrolidin-1-yl]pyridine-3-carbonitrile
CID 166602458
2-(3-ethylpiperazin-1-yl)pyridine-3-carbonitrile
CID 167849231

Frequently Asked Questions

What is the IUPAC name of 2-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]pyridine-3-carbonitrile?
The IUPAC name of 2-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]pyridine-3-carbonitrile (CID 47079116) is 2-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]pyridine-3-carbonitrile.
What is the SMILES notation for 2-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]pyridine-3-carbonitrile?
The canonical SMILES for 2-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]pyridine-3-carbonitrile is N#Cc1cccnc1N1CCCC(N2CCNC2=O)C1.
What is the InChIKey of 2-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]pyridine-3-carbonitrile?
The InChIKey is ZGNCAEWEFBNZRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5O/c15-9-11-3-1-5-16-13(11)18-7-2-4-12(10-18)19-8-6-17-14(19)20/h1,3,5,12H,2,4,6-8,10H2,(H,17,20).
What are the key properties of 2-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]pyridine-3-carbonitrile?
2-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]pyridine-3-carbonitrile has a molecular weight of 271.32 g/mol, XLogP of 0.95, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]pyridine-3-carbonitrile is sourced from PubChem (CID 47079116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).