5-(2,5-difluorophenyl)-1H-imidazole-2-carboxamide

C10H7F2N3O — CID 116883966

IUPAC5-(2,5-difluorophenyl)-1H-imidazole-2-carboxamide
SMILESNC(=O)c1ncc(-c2cc(F)ccc2F)[nH]1
InChIInChI=1S/C10H7F2N3O/c11-5-1-2-7(12)6(3-5)8-4-14-10(15-8)9(13)16/h1-4H,(H2,13,16)(H,14,15)
InChIKeyYKVPBQIUIBJVJB-UHFFFAOYSA-N
MW223.18 g/mol
LogP1.45
Rot. Bonds2

About 5-(2,5-difluorophenyl)-1H-imidazole-2-carboxamide

5-(2,5-difluorophenyl)-1H-imidazole-2-carboxamide (PubChem CID 116883966) has the molecular formula C10H7F2N3O and a molecular weight of 223.18 g/mol. Its IUPAC name is 5-(2,5-difluorophenyl)-1H-imidazole-2-carboxamide.

Molecular Properties

Compound Name5-(2,5-difluorophenyl)-1H-imidazole-2-carboxamide
PubChem CID116883966
Molecular FormulaC10H7F2N3O
Molecular Weight223.18 g/mol
Exact Mass223.06
IUPAC Name5-(2,5-difluorophenyl)-1H-imidazole-2-carboxamide
SMILESNC(=O)c1ncc(-c2cc(F)ccc2F)[nH]1
InChIInChI=1S/C10H7F2N3O/c11-5-1-2-7(12)6(3-5)8-4-14-10(15-8)9(13)16/h1-4H,(H2,13,16)(H,14,15)
InChIKeyYKVPBQIUIBJVJB-UHFFFAOYSA-N
XLogP1.45
TPSA71.77 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.18
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(2,5-difluorophenyl)-1H-imidazole-2-carboxamide?
The IUPAC name of 5-(2,5-difluorophenyl)-1H-imidazole-2-carboxamide (CID 116883966) is 5-(2,5-difluorophenyl)-1H-imidazole-2-carboxamide.
What is the SMILES notation for 5-(2,5-difluorophenyl)-1H-imidazole-2-carboxamide?
The canonical SMILES for 5-(2,5-difluorophenyl)-1H-imidazole-2-carboxamide is NC(=O)c1ncc(-c2cc(F)ccc2F)[nH]1.
What is the InChIKey of 5-(2,5-difluorophenyl)-1H-imidazole-2-carboxamide?
The InChIKey is YKVPBQIUIBJVJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7F2N3O/c11-5-1-2-7(12)6(3-5)8-4-14-10(15-8)9(13)16/h1-4H,(H2,13,16)(H,14,15).
What are the key properties of 5-(2,5-difluorophenyl)-1H-imidazole-2-carboxamide?
5-(2,5-difluorophenyl)-1H-imidazole-2-carboxamide has a molecular weight of 223.18 g/mol, XLogP of 1.45, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,5-difluorophenyl)-1H-imidazole-2-carboxamide is sourced from PubChem (CID 116883966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).