2-[5-(3-fluorophenyl)tetrazol-2-yl]-N-(4-methylcyclohexyl)acetamide

C16H20FN5O — CID 7491136

IUPAC2-[5-(3-fluorophenyl)tetrazol-2-yl]-N-(4-methylcyclohexyl)acetamide
SMILESCC1CCC(NC(=O)Cn2nnc(-c3cccc(F)c3)n2)CC1
InChIInChI=1S/C16H20FN5O/c1-11-5-7-14(8-6-11)18-15(23)10-22-20-16(19-21-22)12-3-2-4-13(17)9-12/h2-4,9,11,14H,5-8,10H2,1H3,(H,18,23)
InChIKeyUKJWYLNUYCQYCS-UHFFFAOYSA-N
MW317.37 g/mol
LogP2.17
Rot. Bonds4

About 2-[5-(3-fluorophenyl)tetrazol-2-yl]-N-(4-methylcyclohexyl)acetamide

2-[5-(3-fluorophenyl)tetrazol-2-yl]-N-(4-methylcyclohexyl)acetamide (PubChem CID 7491136) has the molecular formula C16H20FN5O and a molecular weight of 317.37 g/mol. Its IUPAC name is 2-[5-(3-fluorophenyl)tetrazol-2-yl]-N-(4-methylcyclohexyl)acetamide.

Molecular Properties

Compound Name2-[5-(3-fluorophenyl)tetrazol-2-yl]-N-(4-methylcyclohexyl)acetamide
PubChem CID7491136
Molecular FormulaC16H20FN5O
Molecular Weight317.37 g/mol
Exact Mass317.17
IUPAC Name2-[5-(3-fluorophenyl)tetrazol-2-yl]-N-(4-methylcyclohexyl)acetamide
SMILESCC1CCC(NC(=O)Cn2nnc(-c3cccc(F)c3)n2)CC1
InChIInChI=1S/C16H20FN5O/c1-11-5-7-14(8-6-11)18-15(23)10-22-20-16(19-21-22)12-3-2-4-13(17)9-12/h2-4,9,11,14H,5-8,10H2,1H3,(H,18,23)
InChIKeyUKJWYLNUYCQYCS-UHFFFAOYSA-N
XLogP2.17
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.37
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(1R)-1-cyclopropylethyl]-2-[5-(3-fluorophenyl)tetrazol-2-yl]acetamide
CID 41436763
N-cyclopentyl-2-[5-(3-methylphenyl)tetrazol-2-yl]acetamide
CID 6458492
2-[5-(3-fluorophenyl)tetrazol-2-yl]-N-(2-methylbutan-2-yl)acetamide
CID 17405916
2-[5-(3-fluorophenyl)tetrazol-2-yl]-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide
CID 7490980
2-[5-(3-fluorophenyl)tetrazol-2-yl]-N-(2-methylpropyl)acetamide
CID 30823164
2-[5-(3-fluorophenyl)tetrazol-2-yl]acetamide
CID 30823221
N-(5-fluoro-2-methylphenyl)-2-[5-(3-fluorophenyl)tetrazol-2-yl]acetamide
CID 18171626
2-[5-(3-fluorophenyl)tetrazol-2-yl]-1-(2-methylpiperidin-1-yl)ethanone
CID 46806692
2-[5-(3-fluorophenyl)tetrazol-2-yl]-N-(2-methylsulfanylphenyl)acetamide
CID 7491301
1-(3-fluorophenyl)-2-[5-(3-fluorophenyl)tetrazol-2-yl]ethanone
CID 8676792
2-(3-fluorophenyl)-N-(4-methylcyclohexyl)acetamide
CID 78786047
4-[[2-[5-(3-fluorophenyl)tetrazol-2-yl]acetyl]amino]benzamide
CID 7491286

Frequently Asked Questions

What is the IUPAC name of 2-[5-(3-fluorophenyl)tetrazol-2-yl]-N-(4-methylcyclohexyl)acetamide?
The IUPAC name of 2-[5-(3-fluorophenyl)tetrazol-2-yl]-N-(4-methylcyclohexyl)acetamide (CID 7491136) is 2-[5-(3-fluorophenyl)tetrazol-2-yl]-N-(4-methylcyclohexyl)acetamide.
What is the SMILES notation for 2-[5-(3-fluorophenyl)tetrazol-2-yl]-N-(4-methylcyclohexyl)acetamide?
The canonical SMILES for 2-[5-(3-fluorophenyl)tetrazol-2-yl]-N-(4-methylcyclohexyl)acetamide is CC1CCC(NC(=O)Cn2nnc(-c3cccc(F)c3)n2)CC1.
What is the InChIKey of 2-[5-(3-fluorophenyl)tetrazol-2-yl]-N-(4-methylcyclohexyl)acetamide?
The InChIKey is UKJWYLNUYCQYCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20FN5O/c1-11-5-7-14(8-6-11)18-15(23)10-22-20-16(19-21-22)12-3-2-4-13(17)9-12/h2-4,9,11,14H,5-8,10H2,1H3,(H,18,23).
What are the key properties of 2-[5-(3-fluorophenyl)tetrazol-2-yl]-N-(4-methylcyclohexyl)acetamide?
2-[5-(3-fluorophenyl)tetrazol-2-yl]-N-(4-methylcyclohexyl)acetamide has a molecular weight of 317.37 g/mol, XLogP of 2.17, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(3-fluorophenyl)tetrazol-2-yl]-N-(4-methylcyclohexyl)acetamide is sourced from PubChem (CID 7491136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).