2-(tetrazol-1-yl)-N-[(1R)-2,2,2-trifluoro-1-phenylethyl]acetamide

C11H10F3N5O — CID 95639107

IUPAC2-(tetrazol-1-yl)-N-[(1R)-2,2,2-trifluoro-1-phenylethyl]acetamide
SMILESO=C(Cn1cnnn1)N[C@H](c1ccccc1)C(F)(F)F
InChIInChI=1S/C11H10F3N5O/c12-11(13,14)10(8-4-2-1-3-5-8)16-9(20)6-19-7-15-17-18-19/h1-5,7,10H,6H2,(H,16,20)/t10-/m1/s1
InChIKeyADXWQEVQJFFLID-SNVBAGLBSA-N
MW285.23 g/mol
LogP1.09
Rot. Bonds4

About 2-(tetrazol-1-yl)-N-[(1R)-2,2,2-trifluoro-1-phenylethyl]acetamide

2-(tetrazol-1-yl)-N-[(1R)-2,2,2-trifluoro-1-phenylethyl]acetamide (PubChem CID 95639107) has the molecular formula C11H10F3N5O and a molecular weight of 285.23 g/mol. Its IUPAC name is 2-(tetrazol-1-yl)-N-[(1R)-2,2,2-trifluoro-1-phenylethyl]acetamide.

Molecular Properties

Compound Name2-(tetrazol-1-yl)-N-[(1R)-2,2,2-trifluoro-1-phenylethyl]acetamide
PubChem CID95639107
Molecular FormulaC11H10F3N5O
Molecular Weight285.23 g/mol
Exact Mass285.08
IUPAC Name2-(tetrazol-1-yl)-N-[(1R)-2,2,2-trifluoro-1-phenylethyl]acetamide
SMILESO=C(Cn1cnnn1)N[C@H](c1ccccc1)C(F)(F)F
InChIInChI=1S/C11H10F3N5O/c12-11(13,14)10(8-4-2-1-3-5-8)16-9(20)6-19-7-15-17-18-19/h1-5,7,10H,6H2,(H,16,20)/t10-/m1/s1
InChIKeyADXWQEVQJFFLID-SNVBAGLBSA-N
XLogP1.09
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.23
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-(tetrazol-1-yl)-N-[(1R)-2,2,2-trifluoro-1-phenylethyl]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-[(1S)-1,2-diphenylethyl]-2-(tetrazol-1-yl)acetamide
CID 9117476
2-methyl-3-phenyl-3-[[2-(tetrazol-1-yl)acetyl]amino]propanoic acid
CID 119218600
2-phenyl-3-[[2-(tetrazol-1-yl)acetyl]amino]propanoic acid
CID 62883661
N-[2-(4-chlorophenyl)-1-phenylethyl]-2-(tetrazol-1-yl)acetamide
CID 60548183
N-phenyl-2-(tetrazol-1-yl)acetamide
CID 24977364
N-[(S)-(4-bromo-2-fluorophenyl)-phenylmethyl]-2-(tetrazol-1-yl)acetamide
CID 52724876
N-[(1S)-1-naphthalen-2-ylethyl]-2-(tetrazol-1-yl)acetamide
CID 51513287
N-[(1R)-1-(4-fluorophenyl)-3,3-dimethylbutyl]-2-(tetrazol-1-yl)acetamide
CID 51954474
ethyl (2S)-3-phenyl-2-[[2-(tetrazol-1-yl)acetyl]amino]propanoate
CID 94660700
4-methyl-N-[(1S)-2,2,2-trifluoro-1-phenylethyl]pentanamide
CID 52652867
(2R)-N-cyclopropyl-3-phenyl-2-[[2-(tetrazol-1-yl)acetyl]amino]propanamide
CID 95275372
4-methyl-2-[[2-(tetrazol-1-yl)acetyl]amino]pentanoic acid
CID 24697179

Frequently Asked Questions

What is the IUPAC name of 2-(tetrazol-1-yl)-N-[(1R)-2,2,2-trifluoro-1-phenylethyl]acetamide?
The IUPAC name of 2-(tetrazol-1-yl)-N-[(1R)-2,2,2-trifluoro-1-phenylethyl]acetamide (CID 95639107) is 2-(tetrazol-1-yl)-N-[(1R)-2,2,2-trifluoro-1-phenylethyl]acetamide.
What is the SMILES notation for 2-(tetrazol-1-yl)-N-[(1R)-2,2,2-trifluoro-1-phenylethyl]acetamide?
The canonical SMILES for 2-(tetrazol-1-yl)-N-[(1R)-2,2,2-trifluoro-1-phenylethyl]acetamide is O=C(Cn1cnnn1)N[C@H](c1ccccc1)C(F)(F)F.
What is the InChIKey of 2-(tetrazol-1-yl)-N-[(1R)-2,2,2-trifluoro-1-phenylethyl]acetamide?
The InChIKey is ADXWQEVQJFFLID-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H10F3N5O/c12-11(13,14)10(8-4-2-1-3-5-8)16-9(20)6-19-7-15-17-18-19/h1-5,7,10H,6H2,(H,16,20)/t10-/m1/s1.
What are the key properties of 2-(tetrazol-1-yl)-N-[(1R)-2,2,2-trifluoro-1-phenylethyl]acetamide?
2-(tetrazol-1-yl)-N-[(1R)-2,2,2-trifluoro-1-phenylethyl]acetamide has a molecular weight of 285.23 g/mol, XLogP of 1.09, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(tetrazol-1-yl)-N-[(1R)-2,2,2-trifluoro-1-phenylethyl]acetamide is sourced from PubChem (CID 95639107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).