2-(4-fluorophenyl)-N-[2-methyl-3-(tetrazol-1-yl)phenyl]acetamide

C16H14FN5O — CID 50820832

IUPAC2-(4-fluorophenyl)-N-[2-methyl-3-(tetrazol-1-yl)phenyl]acetamide
SMILESCc1c(NC(=O)Cc2ccc(F)cc2)cccc1-n1cnnn1
InChIInChI=1S/C16H14FN5O/c1-11-14(3-2-4-15(11)22-10-18-20-21-22)19-16(23)9-12-5-7-13(17)8-6-12/h2-8,10H,9H2,1H3,(H,19,23)
InChIKeyYAYZBDWAWPDWFU-UHFFFAOYSA-N
MW311.32 g/mol
LogP2.29
Rot. Bonds4

About 2-(4-fluorophenyl)-N-[2-methyl-3-(tetrazol-1-yl)phenyl]acetamide

2-(4-fluorophenyl)-N-[2-methyl-3-(tetrazol-1-yl)phenyl]acetamide (PubChem CID 50820832) has the molecular formula C16H14FN5O and a molecular weight of 311.32 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-N-[2-methyl-3-(tetrazol-1-yl)phenyl]acetamide.

Molecular Properties

Compound Name2-(4-fluorophenyl)-N-[2-methyl-3-(tetrazol-1-yl)phenyl]acetamide
PubChem CID50820832
Molecular FormulaC16H14FN5O
Molecular Weight311.32 g/mol
Exact Mass311.12
IUPAC Name2-(4-fluorophenyl)-N-[2-methyl-3-(tetrazol-1-yl)phenyl]acetamide
SMILESCc1c(NC(=O)Cc2ccc(F)cc2)cccc1-n1cnnn1
InChIInChI=1S/C16H14FN5O/c1-11-14(3-2-4-15(11)22-10-18-20-21-22)19-16(23)9-12-5-7-13(17)8-6-12/h2-8,10H,9H2,1H3,(H,19,23)
InChIKeyYAYZBDWAWPDWFU-UHFFFAOYSA-N
XLogP2.29
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.32
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-(4-fluorophenyl)-N-[2-methyl-3-(tetrazol-1-yl)phenyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-phenyl-4-(tetrazol-1-yl)benzamide
CID 779646
N-(4-acetylphenyl)-4-(1H-tetrazol-1-yl)benzamide
CID 864758
3-chloro-N-[3-(1H-tetrazol-1-yl)phenyl]benzamide
CID 7693798
4-tert-butyl-N-[3-(1H-tetrazol-1-yl)phenyl]benzamide
CID 7708843
N-[2-(cyclopentylamino)-1-(2-fluorophenyl)-2-oxoethyl]-N-[3-methyl-4-(tetrazol-1-yl)phenyl]prop-2-ynamide
CID 3216701
N-(4-fluorophenyl)-4-(1H-tetrazol-1-ylmethyl)benzamide
CID 712035
N-[4-methyl-3-(1H-tetraazol-1-yl)phenyl]benzamide
CID 855937
4-tert-butyl-N-[4-methyl-3-(tetrazol-1-yl)phenyl]benzamide
CID 855944
(2-chlorophenyl)-N-(4-methyl-3-(1,2,3,4-tetraazolyl)phenyl)carboxamide
CID 855980
2-[(S)-1-((R)-2-Amino-3-phenyl-propionyl)-pyrrolidin-2-yl]-N-(2-tetrazol-1-yl-benzyl)-acetamide
CID 44333068
N-[1-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]-N-methyl-2-[4-(tetrazol-1-yl)phenyl]acetamide
CID 70689386
2-(2-chloro-6-fluorophenyl)-N-[4-(tetrazol-1-yl)phenyl]acetamide
CID 2534187

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-N-[2-methyl-3-(tetrazol-1-yl)phenyl]acetamide?
The IUPAC name of 2-(4-fluorophenyl)-N-[2-methyl-3-(tetrazol-1-yl)phenyl]acetamide (CID 50820832) is 2-(4-fluorophenyl)-N-[2-methyl-3-(tetrazol-1-yl)phenyl]acetamide.
What is the SMILES notation for 2-(4-fluorophenyl)-N-[2-methyl-3-(tetrazol-1-yl)phenyl]acetamide?
The canonical SMILES for 2-(4-fluorophenyl)-N-[2-methyl-3-(tetrazol-1-yl)phenyl]acetamide is Cc1c(NC(=O)Cc2ccc(F)cc2)cccc1-n1cnnn1.
What is the InChIKey of 2-(4-fluorophenyl)-N-[2-methyl-3-(tetrazol-1-yl)phenyl]acetamide?
The InChIKey is YAYZBDWAWPDWFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14FN5O/c1-11-14(3-2-4-15(11)22-10-18-20-21-22)19-16(23)9-12-5-7-13(17)8-6-12/h2-8,10H,9H2,1H3,(H,19,23).
What are the key properties of 2-(4-fluorophenyl)-N-[2-methyl-3-(tetrazol-1-yl)phenyl]acetamide?
2-(4-fluorophenyl)-N-[2-methyl-3-(tetrazol-1-yl)phenyl]acetamide has a molecular weight of 311.32 g/mol, XLogP of 2.29, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-N-[2-methyl-3-(tetrazol-1-yl)phenyl]acetamide is sourced from PubChem (CID 50820832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).