2-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzonitrile

C15H11N3O — CID 7433386

IUPAC2-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzonitrile
SMILESN#Cc1ccccc1OCc1cn2ccccc2n1
InChIInChI=1S/C15H11N3O/c16-9-12-5-1-2-6-14(12)19-11-13-10-18-8-4-3-7-15(18)17-13/h1-8,10H,11H2
InChIKeyXGIDAPWLMPRIKU-UHFFFAOYSA-N
MW249.27 g/mol
LogP2.78
Rot. Bonds3

About 2-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzonitrile

2-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzonitrile (PubChem CID 7433386) has the molecular formula C15H11N3O and a molecular weight of 249.27 g/mol. Its IUPAC name is 2-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzonitrile.

Molecular Properties

Compound Name2-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzonitrile
PubChem CID7433386
Molecular FormulaC15H11N3O
Molecular Weight249.27 g/mol
Exact Mass249.09
IUPAC Name2-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzonitrile
SMILESN#Cc1ccccc1OCc1cn2ccccc2n1
InChIInChI=1S/C15H11N3O/c16-9-12-5-1-2-6-14(12)19-11-13-10-18-8-4-3-7-15(18)17-13/h1-8,10H,11H2
InChIKeyXGIDAPWLMPRIKU-UHFFFAOYSA-N
XLogP2.78
TPSA50.32 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.27
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5-amino-2-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzonitrile
CID 61267731
4-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzonitrile
CID 852438
2-(phenoxymethyl)imidazo[1,2-a]pyridine
CID 4702052
4,5-dichloro-2-(imidazo[1,2-a]pyridin-2-ylmethoxy)aniline
CID 107497897
3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methylbenzoic acid
CID 60698887
3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-5-methoxybenzonitrile
CID 103567182
(1R)-1-[2-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]propan-1-ol
CID 78933268
2-[(1-bromonaphthalen-2-yl)oxymethyl]imidazo[1,2-a]pyridine
CID 1184382
2-[(2-chloro-5-nitrophenoxy)methyl]imidazo[1,2-a]pyridine
CID 79489516
3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzoate
CID 7063876
2-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzenecarboximidamide
CID 24695598
2-[(4-bromo-2-chlorophenoxy)methyl]imidazo[1,2-a]pyridine
CID 112779233

Frequently Asked Questions

What is the IUPAC name of 2-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzonitrile?
The IUPAC name of 2-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzonitrile (CID 7433386) is 2-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzonitrile.
What is the SMILES notation for 2-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzonitrile?
The canonical SMILES for 2-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzonitrile is N#Cc1ccccc1OCc1cn2ccccc2n1.
What is the InChIKey of 2-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzonitrile?
The InChIKey is XGIDAPWLMPRIKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11N3O/c16-9-12-5-1-2-6-14(12)19-11-13-10-18-8-4-3-7-15(18)17-13/h1-8,10H,11H2.
What are the key properties of 2-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzonitrile?
2-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzonitrile has a molecular weight of 249.27 g/mol, XLogP of 2.78, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzonitrile is sourced from PubChem (CID 7433386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).