2-(2,3-dihydro-1H-isoindol-5-yl)-1H-imidazo[4,5-b]pyridine

C14H12N4 — CID 103997607

IUPAC2-(2,3-dihydro-1H-isoindol-5-yl)-1H-imidazo[4,5-b]pyridine
SMILESc1cnc2nc(-c3ccc4c(c3)CNC4)[nH]c2c1
InChIInChI=1S/C14H12N4/c1-2-12-14(16-5-1)18-13(17-12)9-3-4-10-7-15-8-11(10)6-9/h1-6,15H,7-8H2,(H,16,17,18)
InChIKeyFKFJBADVDITXLS-UHFFFAOYSA-N
MW236.28 g/mol
LogP2.23
Rot. Bonds1

About 2-(2,3-dihydro-1H-isoindol-5-yl)-1H-imidazo[4,5-b]pyridine

2-(2,3-dihydro-1H-isoindol-5-yl)-1H-imidazo[4,5-b]pyridine (PubChem CID 103997607) has the molecular formula C14H12N4 and a molecular weight of 236.28 g/mol. Its IUPAC name is 2-(2,3-dihydro-1H-isoindol-5-yl)-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name2-(2,3-dihydro-1H-isoindol-5-yl)-1H-imidazo[4,5-b]pyridine
PubChem CID103997607
Molecular FormulaC14H12N4
Molecular Weight236.28 g/mol
Exact Mass236.11
IUPAC Name2-(2,3-dihydro-1H-isoindol-5-yl)-1H-imidazo[4,5-b]pyridine
SMILESc1cnc2nc(-c3ccc4c(c3)CNC4)[nH]c2c1
InChIInChI=1S/C14H12N4/c1-2-12-14(16-5-1)18-13(17-12)9-3-4-10-7-15-8-11(10)6-9/h1-6,15H,7-8H2,(H,16,17,18)
InChIKeyFKFJBADVDITXLS-UHFFFAOYSA-N
XLogP2.23
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.28
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,3-dihydro-1H-isoindol-5-yl)-1H-imidazo[4,5-b]pyridin-5-amine
CID 103997630
4-(1H-imidazo[4,5-b]pyridin-2-yl)benzonitrile
CID 838912
5-(1H-imidazo[4,5-b]pyridin-2-yl)pyridin-2-amine
CID 63259845
2-(5-fluoro-3-pyridinyl)-1H-imidazo[4,5-b]pyridine
CID 104786090
2-[3-(1H-imidazo[4,5-b]pyridin-2-yl)phenyl]ethanamine
CID 63794425
9-ethyl-3-(1H-imidazo[4,5-b]pyridin-2-yl)carbazole
CID 10041217
2-(1H-imidazo[4,5-b]pyridin-2-yl)-9-phenylcarbazole
CID 162470933
4-(1H-imidazo[4,5-b]pyridin-2-yl)-2,6-dimethoxyphenol
CID 154667096
4-(1H-imidazo[4,5-b]pyridin-2-yl)benzohydrazide
CID 138857529
2-(2,4,6-trifluorophenyl)-1H-imidazo[4,5-b]pyridine
CID 65100220
CID 59368109
CID 59368109
N-ethyl-N-[[5-(1H-imidazo[4,5-b]pyridin-2-yl)-2-methoxyphenyl]methyl]ethanamine
CID 59785489

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1H-isoindol-5-yl)-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 2-(2,3-dihydro-1H-isoindol-5-yl)-1H-imidazo[4,5-b]pyridine (CID 103997607) is 2-(2,3-dihydro-1H-isoindol-5-yl)-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 2-(2,3-dihydro-1H-isoindol-5-yl)-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 2-(2,3-dihydro-1H-isoindol-5-yl)-1H-imidazo[4,5-b]pyridine is c1cnc2nc(-c3ccc4c(c3)CNC4)[nH]c2c1.
What is the InChIKey of 2-(2,3-dihydro-1H-isoindol-5-yl)-1H-imidazo[4,5-b]pyridine?
The InChIKey is FKFJBADVDITXLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N4/c1-2-12-14(16-5-1)18-13(17-12)9-3-4-10-7-15-8-11(10)6-9/h1-6,15H,7-8H2,(H,16,17,18).
What are the key properties of 2-(2,3-dihydro-1H-isoindol-5-yl)-1H-imidazo[4,5-b]pyridine?
2-(2,3-dihydro-1H-isoindol-5-yl)-1H-imidazo[4,5-b]pyridine has a molecular weight of 236.28 g/mol, XLogP of 2.23, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1H-isoindol-5-yl)-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 103997607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).