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

C21H18N4O — CID 121089798

IUPAC1-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-3-(2-methylphenyl)urea
SMILESCc1ccccc1NC(=O)Nc1ccc(-c2cn3ccccc3n2)cc1
InChIInChI=1S/C21H18N4O/c1-15-6-2-3-7-18(15)24-21(26)22-17-11-9-16(10-12-17)19-14-25-13-5-4-8-20(25)23-19/h2-14H,1H3,(H2,22,24,26)
InChIKeyIAJBZHDVOCKCNG-UHFFFAOYSA-N
MW342.40 g/mol
LogP4.95
Rot. Bonds3

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

1-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-3-(2-methylphenyl)urea (PubChem CID 121089798) has the molecular formula C21H18N4O and a molecular weight of 342.40 g/mol. Its IUPAC name is 1-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-3-(2-methylphenyl)urea.

Molecular Properties

Compound Name1-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-3-(2-methylphenyl)urea
PubChem CID121089798
Molecular FormulaC21H18N4O
Molecular Weight342.40 g/mol
Exact Mass342.15
IUPAC Name1-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-3-(2-methylphenyl)urea
SMILESCc1ccccc1NC(=O)Nc1ccc(-c2cn3ccccc3n2)cc1
InChIInChI=1S/C21H18N4O/c1-15-6-2-3-7-18(15)24-21(26)22-17-11-9-16(10-12-17)19-14-25-13-5-4-8-20(25)23-19/h2-14H,1H3,(H2,22,24,26)
InChIKeyIAJBZHDVOCKCNG-UHFFFAOYSA-N
XLogP4.95
TPSA58.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.40
LogP ≤ 54.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2,3-dimethoxyphenyl)-3-(4-imidazo[1,2-a]pyridin-2-ylphenyl)urea
CID 122284184
1-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-3-[4-(trifluoromethoxy)phenyl]urea
CID 122284041
1-(2-ethylphenyl)-3-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]urea
CID 121089872
N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-3-methylbenzamide
CID 40570291
1-(3-fluoro-4-methylphenyl)-3-(3-imidazo[1,2-a]pyridin-2-ylphenyl)urea
CID 121090060
N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)-3,4-dimethylbenzamide
CID 121055609
2-ethyl-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)butanamide
CID 121055624
2-bromo-N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)benzamide
CID 3763346
N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]acetamide
CID 700051
N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)-3-methylbenzamide
CID 121055646
2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)acetamide
CID 37051251
ethane;N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-4-methoxy-2-methylbenzamide
CID 123200330

Frequently Asked Questions

What is the IUPAC name of 1-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-3-(2-methylphenyl)urea?
The IUPAC name of 1-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-3-(2-methylphenyl)urea (CID 121089798) is 1-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-3-(2-methylphenyl)urea.
What is the SMILES notation for 1-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-3-(2-methylphenyl)urea?
The canonical SMILES for 1-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-3-(2-methylphenyl)urea is Cc1ccccc1NC(=O)Nc1ccc(-c2cn3ccccc3n2)cc1.
What is the InChIKey of 1-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-3-(2-methylphenyl)urea?
The InChIKey is IAJBZHDVOCKCNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N4O/c1-15-6-2-3-7-18(15)24-21(26)22-17-11-9-16(10-12-17)19-14-25-13-5-4-8-20(25)23-19/h2-14H,1H3,(H2,22,24,26).
What are the key properties of 1-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-3-(2-methylphenyl)urea?
1-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-3-(2-methylphenyl)urea has a molecular weight of 342.40 g/mol, XLogP of 4.95, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-3-(2-methylphenyl)urea is sourced from PubChem (CID 121089798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).