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

C17H13N5 — CID 143908104

IUPAC3-(7-pyrazin-2-ylimidazo[1,2-a]pyridin-3-yl)aniline
SMILESNc1cccc(-c2cnc3cc(-c4cnccn4)ccn23)c1
InChIInChI=1S/C17H13N5/c18-14-3-1-2-13(8-14)16-11-21-17-9-12(4-7-22(16)17)15-10-19-5-6-20-15/h1-11H,18H2
InChIKeyMFBMQXOGYMKQHE-UHFFFAOYSA-N
MW287.33 g/mol
LogP3.04
Rot. Bonds2

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

3-(7-pyrazin-2-ylimidazo[1,2-a]pyridin-3-yl)aniline (PubChem CID 143908104) has the molecular formula C17H13N5 and a molecular weight of 287.33 g/mol. Its IUPAC name is 3-(7-pyrazin-2-ylimidazo[1,2-a]pyridin-3-yl)aniline.

Molecular Properties

Compound Name3-(7-pyrazin-2-ylimidazo[1,2-a]pyridin-3-yl)aniline
PubChem CID143908104
Molecular FormulaC17H13N5
Molecular Weight287.33 g/mol
Exact Mass287.12
IUPAC Name3-(7-pyrazin-2-ylimidazo[1,2-a]pyridin-3-yl)aniline
SMILESNc1cccc(-c2cnc3cc(-c4cnccn4)ccn23)c1
InChIInChI=1S/C17H13N5/c18-14-3-1-2-13(8-14)16-11-21-17-9-12(4-7-22(16)17)15-10-19-5-6-20-15/h1-11H,18H2
InChIKeyMFBMQXOGYMKQHE-UHFFFAOYSA-N
XLogP3.04
TPSA69.10 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.33
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

3-(7-pyridin-4-ylimidazo[1,2-a]pyridin-3-yl)aniline
CID 89259333
3-[7-(3-methylphenyl)imidazo[1,2-a]pyridin-3-yl]aniline
CID 143707303
3-(7-methoxyimidazo[1,2-a]pyridin-3-yl)aniline
CID 162371946
3-imidazo[1,2-a]pyridin-3-ylaniline;3-[3-(pyridin-3-ylmethyl)phenyl]imidazo[1,2-a]pyridine
CID 159692385
2-[3-(3-methylphenyl)imidazo[1,2-a]pyridin-7-yl]pyrimidin-5-amine
CID 163646899
4-(7-pyridin-4-ylimidazo[1,2-a]pyridin-3-yl)aniline
CID 68541986
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
3-[7-[(E)-2-pyridin-2-ylethenyl]imidazo[1,2-a]pyridin-3-yl]aniline;2,2,2-trifluoroethanamine
CID 143908022
3-(6-chloroimidazo[1,2-b]pyridazin-3-yl)aniline
CID 58857683
3-[3-(1,3-benzodioxol-5-yl)imidazo[1,2-a]pyrazin-6-yl]aniline
CID 155550651
3-imidazo[1,2-a]pyrazin-3-yl-N,N-dimethylbenzamide
CID 162626496

Frequently Asked Questions

What is the IUPAC name of 3-(7-pyrazin-2-ylimidazo[1,2-a]pyridin-3-yl)aniline?
The IUPAC name of 3-(7-pyrazin-2-ylimidazo[1,2-a]pyridin-3-yl)aniline (CID 143908104) is 3-(7-pyrazin-2-ylimidazo[1,2-a]pyridin-3-yl)aniline.
What is the SMILES notation for 3-(7-pyrazin-2-ylimidazo[1,2-a]pyridin-3-yl)aniline?
The canonical SMILES for 3-(7-pyrazin-2-ylimidazo[1,2-a]pyridin-3-yl)aniline is Nc1cccc(-c2cnc3cc(-c4cnccn4)ccn23)c1.
What is the InChIKey of 3-(7-pyrazin-2-ylimidazo[1,2-a]pyridin-3-yl)aniline?
The InChIKey is MFBMQXOGYMKQHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13N5/c18-14-3-1-2-13(8-14)16-11-21-17-9-12(4-7-22(16)17)15-10-19-5-6-20-15/h1-11H,18H2.
What are the key properties of 3-(7-pyrazin-2-ylimidazo[1,2-a]pyridin-3-yl)aniline?
3-(7-pyrazin-2-ylimidazo[1,2-a]pyridin-3-yl)aniline has a molecular weight of 287.33 g/mol, XLogP of 3.04, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(7-pyrazin-2-ylimidazo[1,2-a]pyridin-3-yl)aniline is sourced from PubChem (CID 143908104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).