1-(4-fluorophenyl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)cyclopropane-1-carboxamide

C24H20FN3O — CID 122283624

IUPAC1-(4-fluorophenyl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)cyclopropane-1-carboxamide
SMILESCc1ccc(-c2cn3ccccc3n2)cc1NC(=O)C1(c2ccc(F)cc2)CC1
InChIInChI=1S/C24H20FN3O/c1-16-5-6-17(21-15-28-13-3-2-4-22(28)26-21)14-20(16)27-23(29)24(11-12-24)18-7-9-19(25)10-8-18/h2-10,13-15H,11-12H2,1H3,(H,27,29)
InChIKeyFHFJJCDFVJKBCE-UHFFFAOYSA-N
MW385.44 g/mol
LogP5.12
Rot. Bonds4

About 1-(4-fluorophenyl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)cyclopropane-1-carboxamide

1-(4-fluorophenyl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)cyclopropane-1-carboxamide (PubChem CID 122283624) has the molecular formula C24H20FN3O and a molecular weight of 385.44 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-(4-fluorophenyl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)cyclopropane-1-carboxamide
PubChem CID122283624
Molecular FormulaC24H20FN3O
Molecular Weight385.44 g/mol
Exact Mass385.16
IUPAC Name1-(4-fluorophenyl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)cyclopropane-1-carboxamide
SMILESCc1ccc(-c2cn3ccccc3n2)cc1NC(=O)C1(c2ccc(F)cc2)CC1
InChIInChI=1S/C24H20FN3O/c1-16-5-6-17(21-15-28-13-3-2-4-22(28)26-21)14-20(16)27-23(29)24(11-12-24)18-7-9-19(25)10-8-18/h2-10,13-15H,11-12H2,1H3,(H,27,29)
InChIKeyFHFJJCDFVJKBCE-UHFFFAOYSA-N
XLogP5.12
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms29
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500385.44
LogP ≤ 55.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)cyclopropane-1-carboxamide?
The IUPAC name of 1-(4-fluorophenyl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)cyclopropane-1-carboxamide (CID 122283624) is 1-(4-fluorophenyl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)cyclopropane-1-carboxamide.
What is the SMILES notation for 1-(4-fluorophenyl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)cyclopropane-1-carboxamide?
The canonical SMILES for 1-(4-fluorophenyl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)cyclopropane-1-carboxamide is Cc1ccc(-c2cn3ccccc3n2)cc1NC(=O)C1(c2ccc(F)cc2)CC1.
What is the InChIKey of 1-(4-fluorophenyl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)cyclopropane-1-carboxamide?
The InChIKey is FHFJJCDFVJKBCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20FN3O/c1-16-5-6-17(21-15-28-13-3-2-4-22(28)26-21)14-20(16)27-23(29)24(11-12-24)18-7-9-19(25)10-8-18/h2-10,13-15H,11-12H2,1H3,(H,27,29).
What are the key properties of 1-(4-fluorophenyl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)cyclopropane-1-carboxamide?
1-(4-fluorophenyl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)cyclopropane-1-carboxamide has a molecular weight of 385.44 g/mol, XLogP of 5.12, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 122283624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).