7-(4-fluoroanilino)-N-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide

C24H22F2N6O — CID 134807661

IUPAC7-(4-fluoroanilino)-N-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1nc2n(c1C(=O)Nc1cc(-c3ccc(F)cc3)[nH]n1)CCC(Nc1ccc(F)cc1)C2
InChIInChI=1S/C24H22F2N6O/c1-14-23(24(33)29-21-13-20(30-31-21)15-2-4-16(25)5-3-15)32-11-10-19(12-22(32)27-14)28-18-8-6-17(26)7-9-18/h2-9,13,19,28H,10-12H2,1H3,(H2,29,30,31,33)
InChIKeyQNWFFUFHILQEFD-UHFFFAOYSA-N
MW448.48 g/mol
LogP4.54
Rot. Bonds5

About 7-(4-fluoroanilino)-N-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide

7-(4-fluoroanilino)-N-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 134807661) has the molecular formula C24H22F2N6O and a molecular weight of 448.48 g/mol. Its IUPAC name is 7-(4-fluoroanilino)-N-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name7-(4-fluoroanilino)-N-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide
PubChem CID134807661
Molecular FormulaC24H22F2N6O
Molecular Weight448.48 g/mol
Exact Mass448.18
IUPAC Name7-(4-fluoroanilino)-N-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1nc2n(c1C(=O)Nc1cc(-c3ccc(F)cc3)[nH]n1)CCC(Nc1ccc(F)cc1)C2
InChIInChI=1S/C24H22F2N6O/c1-14-23(24(33)29-21-13-20(30-31-21)15-2-4-16(25)5-3-15)32-11-10-19(12-22(32)27-14)28-18-8-6-17(26)7-9-18/h2-9,13,19,28H,10-12H2,1H3,(H2,29,30,31,33)
InChIKeyQNWFFUFHILQEFD-UHFFFAOYSA-N
XLogP4.54
TPSA87.63 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500448.48
LogP ≤ 54.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-methyl-7-(2-methylanilino)-N-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide
CID 134807417
N-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]benzamide
CID 140931669
N-[5-(2,3-dihydro-1-benzofuran-5-yl)-1H-pyrazol-3-yl]-4-[(1-methylpiperidin-4-yl)amino]benzamide
CID 155536349
N-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-5-methyl-1H-pyrazole-3-carboxamide;formic acid
CID 163341612
4-acetamido-N-[1-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]piperidin-4-yl]benzamide
CID 75528414
N-[4-(3-acetamido-1H-pyrazol-5-yl)phenyl]acetamide
CID 2268930
N-[5-(4-methylphenyl)-1H-pyrazol-3-yl]pyridine-2-carboxamide
CID 167971745
N-[1-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]piperidin-4-yl]benzamide
CID 75528231
N-[1-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]piperidin-4-yl]-2,5-dimethylbenzamide
CID 75528432
(4-fluorophenyl)-[4-(4-methylanilino)piperidin-1-yl]methanone
CID 3936684
N-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-2-(3-oxo-1,2-dihydroisoindol-1-yl)acetamide
CID 155916871
3-fluoro-N-[N-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-N'-(4-methylcyclohexyl)carbamimidoyl]benzamide
CID 57383077

Frequently Asked Questions

What is the IUPAC name of 7-(4-fluoroanilino)-N-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of 7-(4-fluoroanilino)-N-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide (CID 134807661) is 7-(4-fluoroanilino)-N-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for 7-(4-fluoroanilino)-N-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for 7-(4-fluoroanilino)-N-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide is Cc1nc2n(c1C(=O)Nc1cc(-c3ccc(F)cc3)[nH]n1)CCC(Nc1ccc(F)cc1)C2.
What is the InChIKey of 7-(4-fluoroanilino)-N-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is QNWFFUFHILQEFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22F2N6O/c1-14-23(24(33)29-21-13-20(30-31-21)15-2-4-16(25)5-3-15)32-11-10-19(12-22(32)27-14)28-18-8-6-17(26)7-9-18/h2-9,13,19,28H,10-12H2,1H3,(H2,29,30,31,33).
What are the key properties of 7-(4-fluoroanilino)-N-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide?
7-(4-fluoroanilino)-N-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 448.48 g/mol, XLogP of 4.54, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(4-fluoroanilino)-N-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 134807661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).