1-(2-fluorophenyl)-3-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)urea

C20H16FN5O — CID 121033147

IUPAC1-(2-fluorophenyl)-3-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)urea
SMILESCc1ccc(-c2cn3cccnc3n2)cc1NC(=O)Nc1ccccc1F
InChIInChI=1S/C20H16FN5O/c1-13-7-8-14(18-12-26-10-4-9-22-19(26)23-18)11-17(13)25-20(27)24-16-6-3-2-5-15(16)21/h2-12H,1H3,(H2,24,25,27)
InChIKeyLDRVPAMNSWQWBQ-UHFFFAOYSA-N
MW361.38 g/mol
LogP4.49
Rot. Bonds3

About 1-(2-fluorophenyl)-3-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)urea

1-(2-fluorophenyl)-3-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)urea (PubChem CID 121033147) has the molecular formula C20H16FN5O and a molecular weight of 361.38 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-3-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)urea.

Molecular Properties

Compound Name1-(2-fluorophenyl)-3-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)urea
PubChem CID121033147
Molecular FormulaC20H16FN5O
Molecular Weight361.38 g/mol
Exact Mass361.13
IUPAC Name1-(2-fluorophenyl)-3-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)urea
SMILESCc1ccc(-c2cn3cccnc3n2)cc1NC(=O)Nc1ccccc1F
InChIInChI=1S/C20H16FN5O/c1-13-7-8-14(18-12-26-10-4-9-22-19(26)23-18)11-17(13)25-20(27)24-16-6-3-2-5-15(16)21/h2-12H,1H3,(H2,24,25,27)
InChIKeyLDRVPAMNSWQWBQ-UHFFFAOYSA-N
XLogP4.49
TPSA71.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.38
LogP ≤ 54.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)-3-[3-(trifluoromethyl)phenyl]urea
CID 121033146
2-ethyl-N-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)butanamide
CID 7080196
N-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)-2,5-dimethylbenzamide
CID 121033035
N-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)cyclopentanecarboxamide
CID 7080197
1-(3-chloro-4-methoxyphenyl)-3-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)urea
CID 121033137
3-bromo-N-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)benzamide
CID 7080226
5-bromo-2-chloro-N-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)benzamide
CID 27536916
N-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)-2,1,3-benzothiadiazole-5-carboxamide
CID 122285267
N-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)-3-(trifluoromethoxy)benzamide
CID 122285351
N-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)-4-phenyloxane-4-carboxamide
CID 122285268
4-fluoro-N-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)benzenesulfonamide
CID 22581302
1-(2-ethylphenyl)-3-(3-imidazo[1,2-a]pyrimidin-2-ylphenyl)urea
CID 121033112

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-3-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)urea?
The IUPAC name of 1-(2-fluorophenyl)-3-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)urea (CID 121033147) is 1-(2-fluorophenyl)-3-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)urea.
What is the SMILES notation for 1-(2-fluorophenyl)-3-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)urea?
The canonical SMILES for 1-(2-fluorophenyl)-3-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)urea is Cc1ccc(-c2cn3cccnc3n2)cc1NC(=O)Nc1ccccc1F.
What is the InChIKey of 1-(2-fluorophenyl)-3-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)urea?
The InChIKey is LDRVPAMNSWQWBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16FN5O/c1-13-7-8-14(18-12-26-10-4-9-22-19(26)23-18)11-17(13)25-20(27)24-16-6-3-2-5-15(16)21/h2-12H,1H3,(H2,24,25,27).
What are the key properties of 1-(2-fluorophenyl)-3-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)urea?
1-(2-fluorophenyl)-3-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)urea has a molecular weight of 361.38 g/mol, XLogP of 4.49, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-3-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)urea is sourced from PubChem (CID 121033147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).