1-(4-chlorophenyl)-3-(7-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)urea

C21H17ClN4O — CID 42694832

IUPAC1-(4-chlorophenyl)-3-(7-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)urea
SMILESCc1ccn2c(NC(=O)Nc3ccc(Cl)cc3)c(-c3ccccc3)nc2c1
InChIInChI=1S/C21H17ClN4O/c1-14-11-12-26-18(13-14)24-19(15-5-3-2-4-6-15)20(26)25-21(27)23-17-9-7-16(22)8-10-17/h2-13H,1H3,(H2,23,25,27)
InChIKeyFJCNTRVGEMKBIG-UHFFFAOYSA-N
MW376.85 g/mol
LogP5.61
Rot. Bonds3

About 1-(4-chlorophenyl)-3-(7-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)urea

1-(4-chlorophenyl)-3-(7-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)urea (PubChem CID 42694832) has the molecular formula C21H17ClN4O and a molecular weight of 376.85 g/mol. Its IUPAC name is 1-(4-chlorophenyl)-3-(7-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)urea.

Molecular Properties

Compound Name1-(4-chlorophenyl)-3-(7-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)urea
PubChem CID42694832
Molecular FormulaC21H17ClN4O
Molecular Weight376.85 g/mol
Exact Mass376.11
IUPAC Name1-(4-chlorophenyl)-3-(7-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)urea
SMILESCc1ccn2c(NC(=O)Nc3ccc(Cl)cc3)c(-c3ccccc3)nc2c1
InChIInChI=1S/C21H17ClN4O/c1-14-11-12-26-18(13-14)24-19(15-5-3-2-4-6-15)20(26)25-21(27)23-17-9-7-16(22)8-10-17/h2-13H,1H3,(H2,23,25,27)
InChIKeyFJCNTRVGEMKBIG-UHFFFAOYSA-N
XLogP5.61
TPSA58.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500376.85
LogP ≤ 55.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3,4-dimethylphenyl)-3-(7-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)urea
CID 42694834
1-(4-chlorophenyl)-3-[7-methyl-2-(2-phenylethyl)imidazo[1,2-a]pyridin-3-yl]urea
CID 42694847
1-(4-methylphenyl)-3-(2-phenylimidazo[1,2-a]pyridin-3-yl)urea
CID 4825752
N-(7-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)pyridine-2-carboxamide
CID 17417375
1-(3,4-dimethylphenyl)-3-(2-phenylimidazo[1,2-a]pyridin-3-yl)urea
CID 50847541
7-methyl-N-(4-methylphenyl)-2-phenylimidazo[1,2-a]pyridine-3-carboxamide
CID 171983604
N-(7-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2-phenoxyacetamide
CID 3351755
N-(7-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)cyclohexanecarboxamide
CID 40656282
3-bromo-N-(7-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide
CID 2887934
1-[2-(3,5-dimethylphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]-3-[3-(trifluoromethyl)phenyl]urea
CID 42694876
(2S)-2-chloro-N-[7-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]propanamide
CID 93016859
N-[7-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]-2-phenoxyacetamide
CID 42694072

Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)-3-(7-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)urea?
The IUPAC name of 1-(4-chlorophenyl)-3-(7-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)urea (CID 42694832) is 1-(4-chlorophenyl)-3-(7-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)urea.
What is the SMILES notation for 1-(4-chlorophenyl)-3-(7-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)urea?
The canonical SMILES for 1-(4-chlorophenyl)-3-(7-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)urea is Cc1ccn2c(NC(=O)Nc3ccc(Cl)cc3)c(-c3ccccc3)nc2c1.
What is the InChIKey of 1-(4-chlorophenyl)-3-(7-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)urea?
The InChIKey is FJCNTRVGEMKBIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17ClN4O/c1-14-11-12-26-18(13-14)24-19(15-5-3-2-4-6-15)20(26)25-21(27)23-17-9-7-16(22)8-10-17/h2-13H,1H3,(H2,23,25,27).
What are the key properties of 1-(4-chlorophenyl)-3-(7-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)urea?
1-(4-chlorophenyl)-3-(7-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)urea has a molecular weight of 376.85 g/mol, XLogP of 5.61, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)-3-(7-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)urea is sourced from PubChem (CID 42694832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).