8-[(2-ethyl-4-fluoro-6-methylphenyl)methylamino]-2,3-dimethyl-3H-imidazo[1,2-a]pyridine-2-carboxamide

C20H25FN4O — CID 87913182

IUPAC8-[(2-ethyl-4-fluoro-6-methylphenyl)methylamino]-2,3-dimethyl-3H-imidazo[1,2-a]pyridine-2-carboxamide
SMILESCCc1cc(F)cc(C)c1CNC1=CC=CN2C1=NC(C)(C(N)=O)C2C
InChIInChI=1S/C20H25FN4O/c1-5-14-10-15(21)9-12(2)16(14)11-23-17-7-6-8-25-13(3)20(4,19(22)26)24-18(17)25/h6-10,13,23H,5,11H2,1-4H3,(H2,22,26)
InChIKeyDGWBDRXZSFLHBF-UHFFFAOYSA-N
MW356.45 g/mol
LogP2.54
Rot. Bonds5

About 8-[(2-ethyl-4-fluoro-6-methylphenyl)methylamino]-2,3-dimethyl-3H-imidazo[1,2-a]pyridine-2-carboxamide

8-[(2-ethyl-4-fluoro-6-methylphenyl)methylamino]-2,3-dimethyl-3H-imidazo[1,2-a]pyridine-2-carboxamide (PubChem CID 87913182) has the molecular formula C20H25FN4O and a molecular weight of 356.45 g/mol. Its IUPAC name is 8-[(2-ethyl-4-fluoro-6-methylphenyl)methylamino]-2,3-dimethyl-3H-imidazo[1,2-a]pyridine-2-carboxamide.

Molecular Properties

Compound Name8-[(2-ethyl-4-fluoro-6-methylphenyl)methylamino]-2,3-dimethyl-3H-imidazo[1,2-a]pyridine-2-carboxamide
PubChem CID87913182
Molecular FormulaC20H25FN4O
Molecular Weight356.45 g/mol
Exact Mass356.20
IUPAC Name8-[(2-ethyl-4-fluoro-6-methylphenyl)methylamino]-2,3-dimethyl-3H-imidazo[1,2-a]pyridine-2-carboxamide
SMILESCCc1cc(F)cc(C)c1CNC1=CC=CN2C1=NC(C)(C(N)=O)C2C
InChIInChI=1S/C20H25FN4O/c1-5-14-10-15(21)9-12(2)16(14)11-23-17-7-6-8-25-13(3)20(4,19(22)26)24-18(17)25/h6-10,13,23H,5,11H2,1-4H3,(H2,22,26)
InChIKeyDGWBDRXZSFLHBF-UHFFFAOYSA-N
XLogP2.54
TPSA70.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.45
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 8-[(2-ethyl-4-fluoro-6-methylphenyl)methylamino]-2,3-dimethyl-3H-imidazo[1,2-a]pyridine-2-carboxamide?
The IUPAC name of 8-[(2-ethyl-4-fluoro-6-methylphenyl)methylamino]-2,3-dimethyl-3H-imidazo[1,2-a]pyridine-2-carboxamide (CID 87913182) is 8-[(2-ethyl-4-fluoro-6-methylphenyl)methylamino]-2,3-dimethyl-3H-imidazo[1,2-a]pyridine-2-carboxamide.
What is the SMILES notation for 8-[(2-ethyl-4-fluoro-6-methylphenyl)methylamino]-2,3-dimethyl-3H-imidazo[1,2-a]pyridine-2-carboxamide?
The canonical SMILES for 8-[(2-ethyl-4-fluoro-6-methylphenyl)methylamino]-2,3-dimethyl-3H-imidazo[1,2-a]pyridine-2-carboxamide is CCc1cc(F)cc(C)c1CNC1=CC=CN2C1=NC(C)(C(N)=O)C2C.
What is the InChIKey of 8-[(2-ethyl-4-fluoro-6-methylphenyl)methylamino]-2,3-dimethyl-3H-imidazo[1,2-a]pyridine-2-carboxamide?
The InChIKey is DGWBDRXZSFLHBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25FN4O/c1-5-14-10-15(21)9-12(2)16(14)11-23-17-7-6-8-25-13(3)20(4,19(22)26)24-18(17)25/h6-10,13,23H,5,11H2,1-4H3,(H2,22,26).
What are the key properties of 8-[(2-ethyl-4-fluoro-6-methylphenyl)methylamino]-2,3-dimethyl-3H-imidazo[1,2-a]pyridine-2-carboxamide?
8-[(2-ethyl-4-fluoro-6-methylphenyl)methylamino]-2,3-dimethyl-3H-imidazo[1,2-a]pyridine-2-carboxamide has a molecular weight of 356.45 g/mol, XLogP of 2.54, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[(2-ethyl-4-fluoro-6-methylphenyl)methylamino]-2,3-dimethyl-3H-imidazo[1,2-a]pyridine-2-carboxamide is sourced from PubChem (CID 87913182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).