2-fluoro-6-methyl-N-(1H-pyrazol-5-yl)benzamide

C11H10FN3O — CID 171062052

IUPAC2-fluoro-6-methyl-N-(1H-pyrazol-5-yl)benzamide
SMILESCc1cccc(F)c1C(=O)Nc1ccn[nH]1
InChIInChI=1S/C11H10FN3O/c1-7-3-2-4-8(12)10(7)11(16)14-9-5-6-13-15-9/h2-6H,1H3,(H2,13,14,15,16)
InChIKeyAKBJLXFIZXLRTD-UHFFFAOYSA-N
MW219.22 g/mol
LogP2.11
Rot. Bonds2

About 2-fluoro-6-methyl-N-(1H-pyrazol-5-yl)benzamide

2-fluoro-6-methyl-N-(1H-pyrazol-5-yl)benzamide (PubChem CID 171062052) has the molecular formula C11H10FN3O and a molecular weight of 219.22 g/mol. Its IUPAC name is 2-fluoro-6-methyl-N-(1H-pyrazol-5-yl)benzamide.

Molecular Properties

Compound Name2-fluoro-6-methyl-N-(1H-pyrazol-5-yl)benzamide
PubChem CID171062052
Molecular FormulaC11H10FN3O
Molecular Weight219.22 g/mol
Exact Mass219.08
IUPAC Name2-fluoro-6-methyl-N-(1H-pyrazol-5-yl)benzamide
SMILESCc1cccc(F)c1C(=O)Nc1ccn[nH]1
InChIInChI=1S/C11H10FN3O/c1-7-3-2-4-8(12)10(7)11(16)14-9-5-6-13-15-9/h2-6H,1H3,(H2,13,14,15,16)
InChIKeyAKBJLXFIZXLRTD-UHFFFAOYSA-N
XLogP2.11
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.22
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

6-chloro-3-fluoro-2-methyl-N-(1H-pyrazol-5-yl)benzamide
CID 171061998
2,4-difluoro-6-hydroxy-N-(1H-pyrazol-5-yl)benzamide
CID 47466440
N-(1H-pyrazol-5-yl)benzamide
CID 23298723
2-(2,6-dimethylphenoxy)-N-(1H-pyrazol-5-yl)acetamide
CID 61393587
3-[(3-fluoro-4-methylphenyl)sulfonylamino]-N-(1H-pyrazol-5-yl)benzamide
CID 47835606
2-fluoro-N-(1H-pyrazol-5-yl)-3-(trifluoromethyl)benzamide
CID 79885826
2-fluoro-6-methyl-N-methylsulfinylbenzamide
CID 169268764
3-(2,3-dimethylphenoxy)-N-(1H-pyrazol-5-yl)propanamide
CID 61394030
2-fluoro-3-methyl-5-nitro-N-(1H-pyrazol-5-yl)benzamide
CID 107261878
3-bromo-5-fluoro-N-(1H-pyrazol-5-yl)benzamide
CID 61393796
2-fluoro-6-methylbenzoic acid
CID 13478132
3-(2-methylphenoxy)-N-(1H-pyrazol-5-yl)propanamide
CID 61393959

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-6-methyl-N-(1H-pyrazol-5-yl)benzamide?
The IUPAC name of 2-fluoro-6-methyl-N-(1H-pyrazol-5-yl)benzamide (CID 171062052) is 2-fluoro-6-methyl-N-(1H-pyrazol-5-yl)benzamide.
What is the SMILES notation for 2-fluoro-6-methyl-N-(1H-pyrazol-5-yl)benzamide?
The canonical SMILES for 2-fluoro-6-methyl-N-(1H-pyrazol-5-yl)benzamide is Cc1cccc(F)c1C(=O)Nc1ccn[nH]1.
What is the InChIKey of 2-fluoro-6-methyl-N-(1H-pyrazol-5-yl)benzamide?
The InChIKey is AKBJLXFIZXLRTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10FN3O/c1-7-3-2-4-8(12)10(7)11(16)14-9-5-6-13-15-9/h2-6H,1H3,(H2,13,14,15,16).
What are the key properties of 2-fluoro-6-methyl-N-(1H-pyrazol-5-yl)benzamide?
2-fluoro-6-methyl-N-(1H-pyrazol-5-yl)benzamide has a molecular weight of 219.22 g/mol, XLogP of 2.11, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-6-methyl-N-(1H-pyrazol-5-yl)benzamide is sourced from PubChem (CID 171062052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).