6-imidazolidin-2-ylpyridine-3-carbonitrile

C9H10N4 — CID 70037245

IUPAC6-imidazolidin-2-ylpyridine-3-carbonitrile
SMILESN#Cc1ccc(C2NCCN2)nc1
InChIInChI=1S/C9H10N4/c10-5-7-1-2-8(13-6-7)9-11-3-4-12-9/h1-2,6,9,11-12H,3-4H2
InChIKeyYFNAZPHMPQWTLA-UHFFFAOYSA-N
MW174.21 g/mol
LogP0.14
Rot. Bonds1

About 6-imidazolidin-2-ylpyridine-3-carbonitrile

6-imidazolidin-2-ylpyridine-3-carbonitrile (PubChem CID 70037245) has the molecular formula C9H10N4 and a molecular weight of 174.21 g/mol. Its IUPAC name is 6-imidazolidin-2-ylpyridine-3-carbonitrile.

Molecular Properties

Compound Name6-imidazolidin-2-ylpyridine-3-carbonitrile
PubChem CID70037245
Molecular FormulaC9H10N4
Molecular Weight174.21 g/mol
Exact Mass174.09
IUPAC Name6-imidazolidin-2-ylpyridine-3-carbonitrile
SMILESN#Cc1ccc(C2NCCN2)nc1
InChIInChI=1S/C9H10N4/c10-5-7-1-2-8(13-6-7)9-11-3-4-12-9/h1-2,6,9,11-12H,3-4H2
InChIKeyYFNAZPHMPQWTLA-UHFFFAOYSA-N
XLogP0.14
TPSA60.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.21
LogP ≤ 50.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-(4-methylidenecyclohexyl)pyridine-3-carbonitrile
CID 90890322
6-(1-methylpiperidin-4-yl)pyridine-3-carbonitrile
CID 115022328
6-(1-methylpyrrolidin-2-yl)pyridine-3-carbonitrile
CID 115017325
6-[4-(5-cyano-2-pyridinyl)phenyl]pyridine-3-carbonitrile
CID 11849612
6-(3,3-difluorocycloheptyl)pyridine-3-carbonitrile
CID 167959161
6-(1-cyclopropylethoxy)pyridine-3-carbonitrile
CID 126955007
6-[4-(5-chloro-2-pyridinyl)piperidin-1-yl]pyridine-3-carbonitrile
CID 136574445
6-[4-(4-butylcyclohexyl)cyclohexyl]pyridine-3-carbonitrile
CID 139631047
6-(2,5-dimethylpiperazin-1-yl)pyridine-3-carbonitrile
CID 64983286
6-[1-(7-bicyclo[4.1.0]heptanylsulfonyl)piperidin-4-yl]pyridine-3-carbonitrile
CID 155956863
6-(3-pyrrolidin-2-yl-1,2,4-oxadiazol-5-yl)pyridine-3-carbonitrile
CID 63748661
6-(chloromethyl)pyridine-3-carbonitrile
CID 14980535

Frequently Asked Questions

What is the IUPAC name of 6-imidazolidin-2-ylpyridine-3-carbonitrile?
The IUPAC name of 6-imidazolidin-2-ylpyridine-3-carbonitrile (CID 70037245) is 6-imidazolidin-2-ylpyridine-3-carbonitrile.
What is the SMILES notation for 6-imidazolidin-2-ylpyridine-3-carbonitrile?
The canonical SMILES for 6-imidazolidin-2-ylpyridine-3-carbonitrile is N#Cc1ccc(C2NCCN2)nc1.
What is the InChIKey of 6-imidazolidin-2-ylpyridine-3-carbonitrile?
The InChIKey is YFNAZPHMPQWTLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4/c10-5-7-1-2-8(13-6-7)9-11-3-4-12-9/h1-2,6,9,11-12H,3-4H2.
What are the key properties of 6-imidazolidin-2-ylpyridine-3-carbonitrile?
6-imidazolidin-2-ylpyridine-3-carbonitrile has a molecular weight of 174.21 g/mol, XLogP of 0.14, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-imidazolidin-2-ylpyridine-3-carbonitrile is sourced from PubChem (CID 70037245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).