5-fluoro-2-(triazol-1-yl)benzamide

C9H7FN4O — CID 118034900

IUPAC5-fluoro-2-(triazol-1-yl)benzamide
SMILESNC(=O)c1cc(F)ccc1-n1ccnn1
InChIInChI=1S/C9H7FN4O/c10-6-1-2-8(7(5-6)9(11)15)14-4-3-12-13-14/h1-5H,(H2,11,15)
InChIKeyAUSWOBIVPHQVNX-UHFFFAOYSA-N
MW206.18 g/mol
LogP0.51
Rot. Bonds2

About 5-fluoro-2-(triazol-1-yl)benzamide

5-fluoro-2-(triazol-1-yl)benzamide (PubChem CID 118034900) has the molecular formula C9H7FN4O and a molecular weight of 206.18 g/mol. Its IUPAC name is 5-fluoro-2-(triazol-1-yl)benzamide.

Molecular Properties

Compound Name5-fluoro-2-(triazol-1-yl)benzamide
PubChem CID118034900
Molecular FormulaC9H7FN4O
Molecular Weight206.18 g/mol
Exact Mass206.06
IUPAC Name5-fluoro-2-(triazol-1-yl)benzamide
SMILESNC(=O)c1cc(F)ccc1-n1ccnn1
InChIInChI=1S/C9H7FN4O/c10-6-1-2-8(7(5-6)9(11)15)14-4-3-12-13-14/h1-5H,(H2,11,15)
InChIKeyAUSWOBIVPHQVNX-UHFFFAOYSA-N
XLogP0.51
TPSA73.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.18
LogP ≤ 50.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2-Aminophenyl)-(1-phenyltriazol-4-yl)methanone
CID 71681842
(2-Aminophenyl)-[1-[3-(trifluoromethyl)phenyl]triazol-4-yl]methanone
CID 71681841
6-fluoro-2-({[3-(1H-1,2,3-triazol-1-yl)propyl]amino}methyl)quinolin-4-ol
CID 72852461
3,5-difluoro-N-[3-[4-(methylaminomethyl)triazol-1-yl]phenyl]benzamide
CID 171348503
N-[3-[4-[(dimethylamino)methyl]triazol-1-yl]phenyl]-3,5-difluorobenzamide
CID 172444623
2-[1-(2-fluorophenyl)triazol-4-yl]-3H-quinazolin-4-one
CID 177644823
2-[1-(4-fluorophenyl)triazol-4-yl]-3H-quinazolin-4-one
CID 177647277
2-fluoro-N-(2-sulfanylethyl)-5-(triazol-1-yl)benzamide
CID 177679792
5-methyl-4H-triazolo[1,5-a][1,4]benzodiazepin-6-one
CID 11401618
1-(2-(1H-1,2,3-triazol-1-yl)phenyl)ethan-1-one
CID 82602415
2-(1-phenyltriazol-4-yl)-3H-quinazolin-4-one
CID 177643722
4-(1H-1,2,3-Triazol-1-YL)benzaldehyde
CID 10844943

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-(triazol-1-yl)benzamide?
The IUPAC name of 5-fluoro-2-(triazol-1-yl)benzamide (CID 118034900) is 5-fluoro-2-(triazol-1-yl)benzamide.
What is the SMILES notation for 5-fluoro-2-(triazol-1-yl)benzamide?
The canonical SMILES for 5-fluoro-2-(triazol-1-yl)benzamide is NC(=O)c1cc(F)ccc1-n1ccnn1.
What is the InChIKey of 5-fluoro-2-(triazol-1-yl)benzamide?
The InChIKey is AUSWOBIVPHQVNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7FN4O/c10-6-1-2-8(7(5-6)9(11)15)14-4-3-12-13-14/h1-5H,(H2,11,15).
What are the key properties of 5-fluoro-2-(triazol-1-yl)benzamide?
5-fluoro-2-(triazol-1-yl)benzamide has a molecular weight of 206.18 g/mol, XLogP of 0.51, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-(triazol-1-yl)benzamide is sourced from PubChem (CID 118034900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).