3-[7-(3-methylphenyl)imidazo[1,2-a]pyridin-3-yl]aniline

C20H17N3 — CID 143707303

IUPAC3-[7-(3-methylphenyl)imidazo[1,2-a]pyridin-3-yl]aniline
SMILESCc1cccc(-c2ccn3c(-c4cccc(N)c4)cnc3c2)c1
InChIInChI=1S/C20H17N3/c1-14-4-2-5-15(10-14)16-8-9-23-19(13-22-20(23)12-16)17-6-3-7-18(21)11-17/h2-13H,21H2,1H3
InChIKeyYYVVDDZNYISPKA-UHFFFAOYSA-N
MW299.38 g/mol
LogP4.56
Rot. Bonds2

About 3-[7-(3-methylphenyl)imidazo[1,2-a]pyridin-3-yl]aniline

3-[7-(3-methylphenyl)imidazo[1,2-a]pyridin-3-yl]aniline (PubChem CID 143707303) has the molecular formula C20H17N3 and a molecular weight of 299.38 g/mol. Its IUPAC name is 3-[7-(3-methylphenyl)imidazo[1,2-a]pyridin-3-yl]aniline.

Molecular Properties

Compound Name3-[7-(3-methylphenyl)imidazo[1,2-a]pyridin-3-yl]aniline
PubChem CID143707303
Molecular FormulaC20H17N3
Molecular Weight299.38 g/mol
Exact Mass299.14
IUPAC Name3-[7-(3-methylphenyl)imidazo[1,2-a]pyridin-3-yl]aniline
SMILESCc1cccc(-c2ccn3c(-c4cccc(N)c4)cnc3c2)c1
InChIInChI=1S/C20H17N3/c1-14-4-2-5-15(10-14)16-8-9-23-19(13-22-20(23)12-16)17-6-3-7-18(21)11-17/h2-13H,21H2,1H3
InChIKeyYYVVDDZNYISPKA-UHFFFAOYSA-N
XLogP4.56
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.38
LogP ≤ 54.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-[3-(3-methylphenyl)imidazo[1,2-a]pyridin-7-yl]pyrimidin-5-amine
CID 163646899
3-(7-pyridin-4-ylimidazo[1,2-a]pyridin-3-yl)aniline
CID 89259333
3-(7-methoxyimidazo[1,2-a]pyridin-3-yl)aniline
CID 162371946
3-(7-pyrazin-2-ylimidazo[1,2-a]pyridin-3-yl)aniline
CID 143908104
N-ethyl-3-[7-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]aniline;3-[7-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]aniline
CID 161390343
2-(3-phenylimidazo[1,2-a]pyridin-7-yl)aniline
CID 141390574
4-(7-pyridin-4-ylimidazo[1,2-a]pyridin-3-yl)aniline
CID 68541986
3-imidazo[1,2-a]pyridin-3-ylaniline;1-(3-imidazo[1,2-a]pyridin-3-ylphenyl)propan-2-one
CID 162147656
7-methyl-3-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]imidazo[1,2-a]pyridine
CID 11493710
3-(6-chloroimidazo[1,2-b]pyridazin-3-yl)aniline
CID 58857683
3-[3-[7-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]phenyl]-1,2,4-thiadiazol-5-amine
CID 118431180
3-imidazo[1,2-a]pyridin-3-ylaniline;3-[3-(pyridin-3-ylmethyl)phenyl]imidazo[1,2-a]pyridine
CID 159692385

Frequently Asked Questions

What is the IUPAC name of 3-[7-(3-methylphenyl)imidazo[1,2-a]pyridin-3-yl]aniline?
The IUPAC name of 3-[7-(3-methylphenyl)imidazo[1,2-a]pyridin-3-yl]aniline (CID 143707303) is 3-[7-(3-methylphenyl)imidazo[1,2-a]pyridin-3-yl]aniline.
What is the SMILES notation for 3-[7-(3-methylphenyl)imidazo[1,2-a]pyridin-3-yl]aniline?
The canonical SMILES for 3-[7-(3-methylphenyl)imidazo[1,2-a]pyridin-3-yl]aniline is Cc1cccc(-c2ccn3c(-c4cccc(N)c4)cnc3c2)c1.
What is the InChIKey of 3-[7-(3-methylphenyl)imidazo[1,2-a]pyridin-3-yl]aniline?
The InChIKey is YYVVDDZNYISPKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N3/c1-14-4-2-5-15(10-14)16-8-9-23-19(13-22-20(23)12-16)17-6-3-7-18(21)11-17/h2-13H,21H2,1H3.
What are the key properties of 3-[7-(3-methylphenyl)imidazo[1,2-a]pyridin-3-yl]aniline?
3-[7-(3-methylphenyl)imidazo[1,2-a]pyridin-3-yl]aniline has a molecular weight of 299.38 g/mol, XLogP of 4.56, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[7-(3-methylphenyl)imidazo[1,2-a]pyridin-3-yl]aniline is sourced from PubChem (CID 143707303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).