3-(7-pyridin-4-ylimidazo[1,2-a]pyridin-3-yl)aniline

C18H14N4 — CID 89259333

IUPAC3-(7-pyridin-4-ylimidazo[1,2-a]pyridin-3-yl)aniline
SMILESNc1cccc(-c2cnc3cc(-c4ccncc4)ccn23)c1
InChIInChI=1S/C18H14N4/c19-16-3-1-2-15(10-16)17-12-21-18-11-14(6-9-22(17)18)13-4-7-20-8-5-13/h1-12H,19H2
InChIKeyCJBAKEKNTKFJMS-UHFFFAOYSA-N
MW286.34 g/mol
LogP3.65
Rot. Bonds2

About 3-(7-pyridin-4-ylimidazo[1,2-a]pyridin-3-yl)aniline

3-(7-pyridin-4-ylimidazo[1,2-a]pyridin-3-yl)aniline (PubChem CID 89259333) has the molecular formula C18H14N4 and a molecular weight of 286.34 g/mol. Its IUPAC name is 3-(7-pyridin-4-ylimidazo[1,2-a]pyridin-3-yl)aniline.

Molecular Properties

Compound Name3-(7-pyridin-4-ylimidazo[1,2-a]pyridin-3-yl)aniline
PubChem CID89259333
Molecular FormulaC18H14N4
Molecular Weight286.34 g/mol
Exact Mass286.12
IUPAC Name3-(7-pyridin-4-ylimidazo[1,2-a]pyridin-3-yl)aniline
SMILESNc1cccc(-c2cnc3cc(-c4ccncc4)ccn23)c1
InChIInChI=1S/C18H14N4/c19-16-3-1-2-15(10-16)17-12-21-18-11-14(6-9-22(17)18)13-4-7-20-8-5-13/h1-12H,19H2
InChIKeyCJBAKEKNTKFJMS-UHFFFAOYSA-N
XLogP3.65
TPSA56.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.34
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-(7-pyridin-4-ylimidazo[1,2-a]pyridin-3-yl)aniline
CID 68541986
3-[7-(3-methylphenyl)imidazo[1,2-a]pyridin-3-yl]aniline
CID 143707303
3-(7-pyrazin-2-ylimidazo[1,2-a]pyridin-3-yl)aniline
CID 143908104
3-(7-methoxyimidazo[1,2-a]pyridin-3-yl)aniline
CID 162371946
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
7-(4-tert-butylphenyl)-3-pyridin-4-ylimidazo[1,2-a]pyridine
CID 53393117
2-[3-(3-methylphenyl)imidazo[1,2-a]pyridin-7-yl]pyrimidin-5-amine
CID 163646899
3-imidazo[1,2-a]pyridin-3-ylaniline;3-[3-(pyridin-3-ylmethyl)phenyl]imidazo[1,2-a]pyridine
CID 159692385
[3-[7-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-pyridin-4-ylanilino] formate
CID 87543655
2-(3-phenylimidazo[1,2-a]pyridin-7-yl)aniline
CID 141390574
3-[3-[7-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]phenyl]-1,2,4-thiadiazol-5-amine
CID 118431180
7-(4-phenoxyphenyl)-3-phenylimidazo[1,2-a]pyridine
CID 56593403

Frequently Asked Questions

What is the IUPAC name of 3-(7-pyridin-4-ylimidazo[1,2-a]pyridin-3-yl)aniline?
The IUPAC name of 3-(7-pyridin-4-ylimidazo[1,2-a]pyridin-3-yl)aniline (CID 89259333) is 3-(7-pyridin-4-ylimidazo[1,2-a]pyridin-3-yl)aniline.
What is the SMILES notation for 3-(7-pyridin-4-ylimidazo[1,2-a]pyridin-3-yl)aniline?
The canonical SMILES for 3-(7-pyridin-4-ylimidazo[1,2-a]pyridin-3-yl)aniline is Nc1cccc(-c2cnc3cc(-c4ccncc4)ccn23)c1.
What is the InChIKey of 3-(7-pyridin-4-ylimidazo[1,2-a]pyridin-3-yl)aniline?
The InChIKey is CJBAKEKNTKFJMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N4/c19-16-3-1-2-15(10-16)17-12-21-18-11-14(6-9-22(17)18)13-4-7-20-8-5-13/h1-12H,19H2.
What are the key properties of 3-(7-pyridin-4-ylimidazo[1,2-a]pyridin-3-yl)aniline?
3-(7-pyridin-4-ylimidazo[1,2-a]pyridin-3-yl)aniline has a molecular weight of 286.34 g/mol, XLogP of 3.65, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(7-pyridin-4-ylimidazo[1,2-a]pyridin-3-yl)aniline is sourced from PubChem (CID 89259333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).