1-(3-fluoro-4-methylphenyl)-3-(3-imidazo[1,2-a]pyridin-2-ylphenyl)urea

C21H17FN4O — CID 121090060

IUPAC1-(3-fluoro-4-methylphenyl)-3-(3-imidazo[1,2-a]pyridin-2-ylphenyl)urea
SMILESCc1ccc(NC(=O)Nc2cccc(-c3cn4ccccc4n3)c2)cc1F
InChIInChI=1S/C21H17FN4O/c1-14-8-9-17(12-18(14)22)24-21(27)23-16-6-4-5-15(11-16)19-13-26-10-3-2-7-20(26)25-19/h2-13H,1H3,(H2,23,24,27)
InChIKeyLKTYXHPSNAOTEZ-UHFFFAOYSA-N
MW360.39 g/mol
LogP5.09
Rot. Bonds3

About 1-(3-fluoro-4-methylphenyl)-3-(3-imidazo[1,2-a]pyridin-2-ylphenyl)urea

1-(3-fluoro-4-methylphenyl)-3-(3-imidazo[1,2-a]pyridin-2-ylphenyl)urea (PubChem CID 121090060) has the molecular formula C21H17FN4O and a molecular weight of 360.39 g/mol. Its IUPAC name is 1-(3-fluoro-4-methylphenyl)-3-(3-imidazo[1,2-a]pyridin-2-ylphenyl)urea.

Molecular Properties

Compound Name1-(3-fluoro-4-methylphenyl)-3-(3-imidazo[1,2-a]pyridin-2-ylphenyl)urea
PubChem CID121090060
Molecular FormulaC21H17FN4O
Molecular Weight360.39 g/mol
Exact Mass360.14
IUPAC Name1-(3-fluoro-4-methylphenyl)-3-(3-imidazo[1,2-a]pyridin-2-ylphenyl)urea
SMILESCc1ccc(NC(=O)Nc2cccc(-c3cn4ccccc4n3)c2)cc1F
InChIInChI=1S/C21H17FN4O/c1-14-8-9-17(12-18(14)22)24-21(27)23-16-6-4-5-15(11-16)19-13-26-10-3-2-7-20(26)25-19/h2-13H,1H3,(H2,23,24,27)
InChIKeyLKTYXHPSNAOTEZ-UHFFFAOYSA-N
XLogP5.09
TPSA58.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500360.39
LogP ≤ 55.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-(3-fluoro-4-methylphenyl)-3-(3-imidazo[1,2-a]pyridin-2-ylphenyl)urea with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)propanamide
CID 877528
3,4-difluoro-N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)benzamide
CID 122283315
1-(2,3-dimethoxyphenyl)-3-(3-imidazo[1,2-a]pyridin-2-ylphenyl)urea
CID 122283501
N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-3-methylbutanamide
CID 845423
N-[4-[(3-imidazo[1,2-a]pyridin-2-ylphenyl)sulfamoyl]-3-methylphenyl]acetamide
CID 122283470
1-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-3-(2-methylphenyl)urea
CID 121089798
1-(3,4-difluorophenyl)-3-(3-imidazo[1,2-a]pyrimidin-2-ylphenyl)urea
CID 122285057
1-(3-fluoro-4-methylphenyl)-3-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)urea
CID 43936550
(E)-3-(4-chlorophenyl)-N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)prop-2-enamide
CID 122283426
N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-2-pyrimidin-2-yloxyacetamide
CID 121086799
1-(3-fluorophenyl)-3-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]urea
CID 121089870
1-(3-fluoro-4-methylphenyl)-3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)urea
CID 53204464

Frequently Asked Questions

What is the IUPAC name of 1-(3-fluoro-4-methylphenyl)-3-(3-imidazo[1,2-a]pyridin-2-ylphenyl)urea?
The IUPAC name of 1-(3-fluoro-4-methylphenyl)-3-(3-imidazo[1,2-a]pyridin-2-ylphenyl)urea (CID 121090060) is 1-(3-fluoro-4-methylphenyl)-3-(3-imidazo[1,2-a]pyridin-2-ylphenyl)urea.
What is the SMILES notation for 1-(3-fluoro-4-methylphenyl)-3-(3-imidazo[1,2-a]pyridin-2-ylphenyl)urea?
The canonical SMILES for 1-(3-fluoro-4-methylphenyl)-3-(3-imidazo[1,2-a]pyridin-2-ylphenyl)urea is Cc1ccc(NC(=O)Nc2cccc(-c3cn4ccccc4n3)c2)cc1F.
What is the InChIKey of 1-(3-fluoro-4-methylphenyl)-3-(3-imidazo[1,2-a]pyridin-2-ylphenyl)urea?
The InChIKey is LKTYXHPSNAOTEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17FN4O/c1-14-8-9-17(12-18(14)22)24-21(27)23-16-6-4-5-15(11-16)19-13-26-10-3-2-7-20(26)25-19/h2-13H,1H3,(H2,23,24,27).
What are the key properties of 1-(3-fluoro-4-methylphenyl)-3-(3-imidazo[1,2-a]pyridin-2-ylphenyl)urea?
1-(3-fluoro-4-methylphenyl)-3-(3-imidazo[1,2-a]pyridin-2-ylphenyl)urea has a molecular weight of 360.39 g/mol, XLogP of 5.09, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluoro-4-methylphenyl)-3-(3-imidazo[1,2-a]pyridin-2-ylphenyl)urea is sourced from PubChem (CID 121090060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).