(3,4-difluorophenyl)-(1H-imidazol-2-yl)methanone

C10H6F2N2O — CID 112731511

IUPAC(3,4-difluorophenyl)-(1H-imidazol-2-yl)methanone
SMILESO=C(c1ccc(F)c(F)c1)c1ncc[nH]1
InChIInChI=1S/C10H6F2N2O/c11-7-2-1-6(5-8(7)12)9(15)10-13-3-4-14-10/h1-5H,(H,13,14)
InChIKeyLPKFJVVYHGFVMI-UHFFFAOYSA-N
MW208.17 g/mol
LogP1.92
Rot. Bonds2

About (3,4-difluorophenyl)-(1H-imidazol-2-yl)methanone

(3,4-difluorophenyl)-(1H-imidazol-2-yl)methanone (PubChem CID 112731511) has the molecular formula C10H6F2N2O and a molecular weight of 208.17 g/mol. Its IUPAC name is (3,4-difluorophenyl)-(1H-imidazol-2-yl)methanone.

Molecular Properties

Compound Name(3,4-difluorophenyl)-(1H-imidazol-2-yl)methanone
PubChem CID112731511
Molecular FormulaC10H6F2N2O
Molecular Weight208.17 g/mol
Exact Mass208.04
IUPAC Name(3,4-difluorophenyl)-(1H-imidazol-2-yl)methanone
SMILESO=C(c1ccc(F)c(F)c1)c1ncc[nH]1
InChIInChI=1S/C10H6F2N2O/c11-7-2-1-6(5-8(7)12)9(15)10-13-3-4-14-10/h1-5H,(H,13,14)
InChIKeyLPKFJVVYHGFVMI-UHFFFAOYSA-N
XLogP1.92
TPSA45.75 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.17
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3,4-difluoro-N-(1H-imidazol-2-yl)benzamide
CID 63565198
4-(3,4-difluorobenzoyl)-1H-imidazole-5-carboxylic acid
CID 116520126
bis(1H-imidazol-2-yl)methanone;oxalyl dichloride
CID 19366628
(3,4-difluorophenyl)-(3,4-dihydroxyphenyl)methanone
CID 117000378
(3,4-difluorophenyl)-(4-iodophenyl)methanone
CID 24723141
(2,4-dichlorophenyl)-(3,4-difluorophenyl)methanone
CID 43338229
(3,4-difluorophenyl)-quinolin-4-ylmethanone
CID 86811172
(3,4-difluorophenyl)-(3,4-dimethylphenyl)methanone
CID 583629
(3,4-difluorophenyl)-(2,3-dihydro-1H-indol-6-yl)methanone
CID 116611865
2-(1H-imidazole-2-carbonyl)benzamide
CID 607520
(3,4-difluorophenyl)-(2,5-dimethylphenyl)methanone
CID 43337256
5-(3,4-difluorobenzoyl)-1,3-dihydrobenzimidazol-2-one
CID 43338650

Frequently Asked Questions

What is the IUPAC name of (3,4-difluorophenyl)-(1H-imidazol-2-yl)methanone?
The IUPAC name of (3,4-difluorophenyl)-(1H-imidazol-2-yl)methanone (CID 112731511) is (3,4-difluorophenyl)-(1H-imidazol-2-yl)methanone.
What is the SMILES notation for (3,4-difluorophenyl)-(1H-imidazol-2-yl)methanone?
The canonical SMILES for (3,4-difluorophenyl)-(1H-imidazol-2-yl)methanone is O=C(c1ccc(F)c(F)c1)c1ncc[nH]1.
What is the InChIKey of (3,4-difluorophenyl)-(1H-imidazol-2-yl)methanone?
The InChIKey is LPKFJVVYHGFVMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6F2N2O/c11-7-2-1-6(5-8(7)12)9(15)10-13-3-4-14-10/h1-5H,(H,13,14).
What are the key properties of (3,4-difluorophenyl)-(1H-imidazol-2-yl)methanone?
(3,4-difluorophenyl)-(1H-imidazol-2-yl)methanone has a molecular weight of 208.17 g/mol, XLogP of 1.92, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3,4-difluorophenyl)-(1H-imidazol-2-yl)methanone is sourced from PubChem (CID 112731511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).