5,7-dimethyl-2-(3,4,5-trifluorophenyl)imidazo[1,2-a]pyridin-3-amine

C15H12F3N3 — CID 114933426

IUPAC5,7-dimethyl-2-(3,4,5-trifluorophenyl)imidazo[1,2-a]pyridin-3-amine
SMILESCc1cc(C)n2c(N)c(-c3cc(F)c(F)c(F)c3)nc2c1
InChIInChI=1S/C15H12F3N3/c1-7-3-8(2)21-12(4-7)20-14(15(21)19)9-5-10(16)13(18)11(17)6-9/h3-6H,19H2,1-2H3
InChIKeyPHFNJITVWCXCQY-UHFFFAOYSA-N
MW291.28 g/mol
LogP3.62
Rot. Bonds1

About 5,7-dimethyl-2-(3,4,5-trifluorophenyl)imidazo[1,2-a]pyridin-3-amine

5,7-dimethyl-2-(3,4,5-trifluorophenyl)imidazo[1,2-a]pyridin-3-amine (PubChem CID 114933426) has the molecular formula C15H12F3N3 and a molecular weight of 291.28 g/mol. Its IUPAC name is 5,7-dimethyl-2-(3,4,5-trifluorophenyl)imidazo[1,2-a]pyridin-3-amine.

Molecular Properties

Compound Name5,7-dimethyl-2-(3,4,5-trifluorophenyl)imidazo[1,2-a]pyridin-3-amine
PubChem CID114933426
Molecular FormulaC15H12F3N3
Molecular Weight291.28 g/mol
Exact Mass291.10
IUPAC Name5,7-dimethyl-2-(3,4,5-trifluorophenyl)imidazo[1,2-a]pyridin-3-amine
SMILESCc1cc(C)n2c(N)c(-c3cc(F)c(F)c(F)c3)nc2c1
InChIInChI=1S/C15H12F3N3/c1-7-3-8(2)21-12(4-7)20-14(15(21)19)9-5-10(16)13(18)11(17)6-9/h3-6H,19H2,1-2H3
InChIKeyPHFNJITVWCXCQY-UHFFFAOYSA-N
XLogP3.62
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.28
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}

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Related Compounds

2-(2-chloro-6-fluorophenyl)-5,7-dimethylimidazo[1,2-a]pyridin-3-amine
CID 114933530
5,7-dimethyl-2-(2-methylpyrazol-3-yl)imidazo[1,2-a]pyridin-3-amine
CID 114933487
2-(3,4-difluorophenyl)-5-methylimidazo[1,2-a]pyridin-3-amine
CID 55247422
2-(5-ethylthiophen-2-yl)-5,7-dimethylimidazo[1,2-a]pyridin-3-amine
CID 114933475
2-(4-bromo-5-chlorothiophen-2-yl)-5,7-dimethylimidazo[1,2-a]pyridin-3-amine
CID 102844435
2-(2,3-dichlorophenyl)-5,7-dimethylimidazo[1,2-a]pyridin-3-amine
CID 114933504
2-(2,2-dimethylpropyl)-5,7-dimethylimidazo[1,2-a]pyridin-3-amine
CID 114933450
2-(3,4,5-trifluorophenyl)imidazo[1,2-a]pyridin-3-amine
CID 63618084
2-(3-fluoro-4-methoxyphenyl)-5-methylimidazo[1,2-a]pyridin-3-amine
CID 65101402
3-methyl-5-(3,4,5-trifluorophenyl)aniline
CID 107579493
3-cyclopropyl-2-propyl-5-(3,4,5-trifluorophenyl)imidazol-4-amine
CID 63050859
2,3-dipropyl-5-(3,4,5-trifluorophenyl)imidazol-4-amine
CID 63050525

Frequently Asked Questions

What is the IUPAC name of 5,7-dimethyl-2-(3,4,5-trifluorophenyl)imidazo[1,2-a]pyridin-3-amine?
The IUPAC name of 5,7-dimethyl-2-(3,4,5-trifluorophenyl)imidazo[1,2-a]pyridin-3-amine (CID 114933426) is 5,7-dimethyl-2-(3,4,5-trifluorophenyl)imidazo[1,2-a]pyridin-3-amine.
What is the SMILES notation for 5,7-dimethyl-2-(3,4,5-trifluorophenyl)imidazo[1,2-a]pyridin-3-amine?
The canonical SMILES for 5,7-dimethyl-2-(3,4,5-trifluorophenyl)imidazo[1,2-a]pyridin-3-amine is Cc1cc(C)n2c(N)c(-c3cc(F)c(F)c(F)c3)nc2c1.
What is the InChIKey of 5,7-dimethyl-2-(3,4,5-trifluorophenyl)imidazo[1,2-a]pyridin-3-amine?
The InChIKey is PHFNJITVWCXCQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12F3N3/c1-7-3-8(2)21-12(4-7)20-14(15(21)19)9-5-10(16)13(18)11(17)6-9/h3-6H,19H2,1-2H3.
What are the key properties of 5,7-dimethyl-2-(3,4,5-trifluorophenyl)imidazo[1,2-a]pyridin-3-amine?
5,7-dimethyl-2-(3,4,5-trifluorophenyl)imidazo[1,2-a]pyridin-3-amine has a molecular weight of 291.28 g/mol, XLogP of 3.62, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-dimethyl-2-(3,4,5-trifluorophenyl)imidazo[1,2-a]pyridin-3-amine is sourced from PubChem (CID 114933426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).