N-(4-fluorophenyl)-2-[5-(2-methylphenyl)tetrazol-2-yl]acetamide

C16H14FN5O — CID 709177

IUPACN-(4-fluorophenyl)-2-[5-(2-methylphenyl)tetrazol-2-yl]acetamide
SMILESCc1ccccc1-c1nnn(CC(=O)Nc2ccc(F)cc2)n1
InChIInChI=1S/C16H14FN5O/c1-11-4-2-3-5-14(11)16-19-21-22(20-16)10-15(23)18-13-8-6-12(17)7-9-13/h2-9H,10H2,1H3,(H,18,23)
InChIKeySKMIYOJKHHUTPL-UHFFFAOYSA-N
MW311.32 g/mol
LogP2.43
Rot. Bonds4

About N-(4-fluorophenyl)-2-[5-(2-methylphenyl)tetrazol-2-yl]acetamide

N-(4-fluorophenyl)-2-[5-(2-methylphenyl)tetrazol-2-yl]acetamide (PubChem CID 709177) has the molecular formula C16H14FN5O and a molecular weight of 311.32 g/mol. Its IUPAC name is N-(4-fluorophenyl)-2-[5-(2-methylphenyl)tetrazol-2-yl]acetamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-2-[5-(2-methylphenyl)tetrazol-2-yl]acetamide
PubChem CID709177
Molecular FormulaC16H14FN5O
Molecular Weight311.32 g/mol
Exact Mass311.12
IUPAC NameN-(4-fluorophenyl)-2-[5-(2-methylphenyl)tetrazol-2-yl]acetamide
SMILESCc1ccccc1-c1nnn(CC(=O)Nc2ccc(F)cc2)n1
InChIInChI=1S/C16H14FN5O/c1-11-4-2-3-5-14(11)16-19-21-22(20-16)10-15(23)18-13-8-6-12(17)7-9-13/h2-9H,10H2,1H3,(H,18,23)
InChIKeySKMIYOJKHHUTPL-UHFFFAOYSA-N
XLogP2.43
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 ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(4-fluorophenyl)-2-[5-(2-methylphenyl)tetrazol-2-yl]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

Cyclobutanecarboxylic acid (3-{2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]-2H-tetrazol-5-yl}-phenyl)-amide
CID 651981
N-(2,4-Difluoro-phenyl)-2-(2-dodecyl-2H-tetrazol-5-yl)-2-phenyl-acetamide
CID 9805324
2-Fluoro-N-{3-[2-(isopropylcarbamoyl-methyl)-2H-tetrazol-5-yl]-phenyl}-benzamide
CID 646056
N-(2-{2-[2-(2-Methyl-2,3-dihydro-indol-1-yl)-2-oxo-ethyl]-2H-tetrazol-5-yl}-phenyl)-propionamide
CID 650750
N-[2-(2-Ethyl-2H-tetrazol-5-yl)-phenyl]-2,2,2-trifluoro-acetamide
CID 652435
2-[5-(2-fluorophenyl)-2-tetrazolyl]-N-[2-oxo-2-[(phenylmethyl)amino]ethyl]-N-(5,6,7,8-tetrahydronaphthalen-1-yl)acetamide
CID 1143706
1-(4-fluorophenyl)-4-[(5-phenyl-2H-tetrazol-2-yl)acetyl]piperazine
CID 1264121
N-[2-[2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]tetrazol-5-yl]phenyl]-3-methylbutanamide
CID 1440203
N-(tert-Butylcarbamoyl-methyl)-2-[5-(2-fluoro-phenyl)-tetrazol-2-yl]-N-(5,6,7,8-tetrahydro-naphthalen-1-yl)-acetamide
CID 3190063
N-tert-Butyl-2-[{2-[5-(2-fluoro-phenyl)-tetrazol-2-yl]-acetyl}-(5,6,7,8-tetrahydro-naphthalen-1-yl)-amino]-butyramide
CID 3190066
[2-(2,5-Difluoroanilino)-2-oxoethyl] 2-(5-phenyltetrazol-2-yl)acetate
CID 2436905
N-[3-[5-[2-[4-(trifluoromethyl)anilino]phenyl]tetrazol-2-yl]propyl]acetamide
CID 135371577

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-2-[5-(2-methylphenyl)tetrazol-2-yl]acetamide?
The IUPAC name of N-(4-fluorophenyl)-2-[5-(2-methylphenyl)tetrazol-2-yl]acetamide (CID 709177) is N-(4-fluorophenyl)-2-[5-(2-methylphenyl)tetrazol-2-yl]acetamide.
What is the SMILES notation for N-(4-fluorophenyl)-2-[5-(2-methylphenyl)tetrazol-2-yl]acetamide?
The canonical SMILES for N-(4-fluorophenyl)-2-[5-(2-methylphenyl)tetrazol-2-yl]acetamide is Cc1ccccc1-c1nnn(CC(=O)Nc2ccc(F)cc2)n1.
What is the InChIKey of N-(4-fluorophenyl)-2-[5-(2-methylphenyl)tetrazol-2-yl]acetamide?
The InChIKey is SKMIYOJKHHUTPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14FN5O/c1-11-4-2-3-5-14(11)16-19-21-22(20-16)10-15(23)18-13-8-6-12(17)7-9-13/h2-9H,10H2,1H3,(H,18,23).
What are the key properties of N-(4-fluorophenyl)-2-[5-(2-methylphenyl)tetrazol-2-yl]acetamide?
N-(4-fluorophenyl)-2-[5-(2-methylphenyl)tetrazol-2-yl]acetamide has a molecular weight of 311.32 g/mol, XLogP of 2.43, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-2-[5-(2-methylphenyl)tetrazol-2-yl]acetamide is sourced from PubChem (CID 709177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).