N-(2-fluorophenyl)-5-methyl-4,5-dihydro-1H-imidazole-2-carboxamide

C11H12FN3O — CID 91902182

IUPACN-(2-fluorophenyl)-5-methyl-4,5-dihydro-1H-imidazole-2-carboxamide
SMILESCC1CN=C(C(=O)Nc2ccccc2F)N1
InChIInChI=1S/C11H12FN3O/c1-7-6-13-10(14-7)11(16)15-9-5-3-2-4-8(9)12/h2-5,7H,6H2,1H3,(H,13,14)(H,15,16)
InChIKeyQZKCFMCDCRRCBV-UHFFFAOYSA-N
MW221.24 g/mol
LogP1.15
Rot. Bonds2

About N-(2-fluorophenyl)-5-methyl-4,5-dihydro-1H-imidazole-2-carboxamide

N-(2-fluorophenyl)-5-methyl-4,5-dihydro-1H-imidazole-2-carboxamide (PubChem CID 91902182) has the molecular formula C11H12FN3O and a molecular weight of 221.24 g/mol. Its IUPAC name is N-(2-fluorophenyl)-5-methyl-4,5-dihydro-1H-imidazole-2-carboxamide.

Molecular Properties

Compound NameN-(2-fluorophenyl)-5-methyl-4,5-dihydro-1H-imidazole-2-carboxamide
PubChem CID91902182
Molecular FormulaC11H12FN3O
Molecular Weight221.24 g/mol
Exact Mass221.10
IUPAC NameN-(2-fluorophenyl)-5-methyl-4,5-dihydro-1H-imidazole-2-carboxamide
SMILESCC1CN=C(C(=O)Nc2ccccc2F)N1
InChIInChI=1S/C11H12FN3O/c1-7-6-13-10(14-7)11(16)15-9-5-3-2-4-8(9)12/h2-5,7H,6H2,1H3,(H,13,14)(H,15,16)
InChIKeyQZKCFMCDCRRCBV-UHFFFAOYSA-N
XLogP1.15
TPSA53.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.24
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,3-dichlorophenyl)-5-methyl-4,5-dihydro-1H-imidazole-2-carboxamide
CID 91902197
(4R)-N-(2-fluorophenyl)-4-(4-fluorophenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide
CID 7164273
1-N-[2-(dimethylamino)ethyl]-4-N-(2-fluorophenyl)cyclohexane-1,4-dicarboxamide
CID 109147107
6-N-cyclopropyl-2-N-(2-fluorophenyl)pyridine-2,6-dicarboxamide
CID 109093918
1-(2-fluorophenyl)-3-piperidin-4-ylurea
CID 16785411
N-(2-fluorophenyl)-1H-pyrrole-2-carboxamide
CID 51210810
2-(ethylamino)-N-(2-fluorophenyl)benzamide
CID 55042608
N-(2-fluorophenyl)-1,4,6,7-tetrahydropyrano[4,3-c]pyrazole-3-carboxamide
CID 84577883
2,6-difluoro-N-(2-fluorophenyl)pyridine-4-carboxamide
CID 148924135
(4R)-4-(4-bromophenyl)-N-(2-fluorophenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide
CID 27600970
(3R)-N-(2-fluorophenyl)-3-methylpiperidine-1-carboxamide
CID 41097666
1-N-cyclohexyl-4-N-(2-fluorophenyl)benzene-1,4-dicarboxamide
CID 109044796

Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-5-methyl-4,5-dihydro-1H-imidazole-2-carboxamide?
The IUPAC name of N-(2-fluorophenyl)-5-methyl-4,5-dihydro-1H-imidazole-2-carboxamide (CID 91902182) is N-(2-fluorophenyl)-5-methyl-4,5-dihydro-1H-imidazole-2-carboxamide.
What is the SMILES notation for N-(2-fluorophenyl)-5-methyl-4,5-dihydro-1H-imidazole-2-carboxamide?
The canonical SMILES for N-(2-fluorophenyl)-5-methyl-4,5-dihydro-1H-imidazole-2-carboxamide is CC1CN=C(C(=O)Nc2ccccc2F)N1.
What is the InChIKey of N-(2-fluorophenyl)-5-methyl-4,5-dihydro-1H-imidazole-2-carboxamide?
The InChIKey is QZKCFMCDCRRCBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12FN3O/c1-7-6-13-10(14-7)11(16)15-9-5-3-2-4-8(9)12/h2-5,7H,6H2,1H3,(H,13,14)(H,15,16).
What are the key properties of N-(2-fluorophenyl)-5-methyl-4,5-dihydro-1H-imidazole-2-carboxamide?
N-(2-fluorophenyl)-5-methyl-4,5-dihydro-1H-imidazole-2-carboxamide has a molecular weight of 221.24 g/mol, XLogP of 1.15, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)-5-methyl-4,5-dihydro-1H-imidazole-2-carboxamide is sourced from PubChem (CID 91902182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).