N-[1-methyl-6-(trifluoromethyl)piperidin-3-yl]-2-(tetrazol-1-yl)acetamide

C10H15F3N6O — CID 128981229

IUPACN-[1-methyl-6-(trifluoromethyl)piperidin-3-yl]-2-(tetrazol-1-yl)acetamide
SMILESCN1CC(NC(=O)Cn2cnnn2)CCC1C(F)(F)F
InChIInChI=1S/C10H15F3N6O/c1-18-4-7(2-3-8(18)10(11,12)13)15-9(20)5-19-6-14-16-17-19/h6-8H,2-5H2,1H3,(H,15,20)
InChIKeyTZIWWQXFBLGYJP-UHFFFAOYSA-N
MW292.27 g/mol
LogP-0.19
Rot. Bonds3

About N-[1-methyl-6-(trifluoromethyl)piperidin-3-yl]-2-(tetrazol-1-yl)acetamide

N-[1-methyl-6-(trifluoromethyl)piperidin-3-yl]-2-(tetrazol-1-yl)acetamide (PubChem CID 128981229) has the molecular formula C10H15F3N6O and a molecular weight of 292.27 g/mol. Its IUPAC name is N-[1-methyl-6-(trifluoromethyl)piperidin-3-yl]-2-(tetrazol-1-yl)acetamide.

Molecular Properties

Compound NameN-[1-methyl-6-(trifluoromethyl)piperidin-3-yl]-2-(tetrazol-1-yl)acetamide
PubChem CID128981229
Molecular FormulaC10H15F3N6O
Molecular Weight292.27 g/mol
Exact Mass292.13
IUPAC NameN-[1-methyl-6-(trifluoromethyl)piperidin-3-yl]-2-(tetrazol-1-yl)acetamide
SMILESCN1CC(NC(=O)Cn2cnnn2)CCC1C(F)(F)F
InChIInChI=1S/C10H15F3N6O/c1-18-4-7(2-3-8(18)10(11,12)13)15-9(20)5-19-6-14-16-17-19/h6-8H,2-5H2,1H3,(H,15,20)
InChIKeyTZIWWQXFBLGYJP-UHFFFAOYSA-N
XLogP-0.19
TPSA75.94 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.27
LogP ≤ 5-0.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[4-(methylamino)cyclohexyl]-2-(tetrazol-1-yl)acetamide
CID 79111193
2-(tetrazol-1-yl)-N-[(1S,3R)-3-(trifluoromethyl)cyclohexyl]acetamide
CID 94151419
N-[4-(2-methylbutan-2-yl)cyclohexyl]-2-(tetrazol-1-yl)acetamide
CID 134029552
N-(1-propanoylazepan-3-yl)-2-(tetrazol-1-yl)acetamide
CID 70733307
1-methyl-2-[[2-(tetrazol-1-yl)acetyl]amino]cyclopentane-1-carboxylic acid
CID 82760433
N-[1-(4-chloro-3-fluorophenyl)pyrrolidin-3-yl]-2-(tetrazol-1-yl)acetamide
CID 75470219
N-(4-methylpyrrolidin-3-yl)-2-(tetrazol-1-yl)acetamide
CID 104826317
N-[(3S)-1-[2-(difluoromethoxy)phenyl]pyrrolidin-3-yl]-2-(tetrazol-1-yl)acetamide
CID 124564998
N-[4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]cyclohexyl]-2-(tetrazol-1-yl)acetamide
CID 176503419
N-ethyl-2-(tetrazol-1-yl)acetamide
CID 130679342
N-[2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]ethyl]-2-(tetrazol-1-yl)acetamide
CID 94116447
N-(2,2-difluoro-3-hydroxypropyl)-2-(tetrazol-1-yl)acetamide
CID 104857271

Frequently Asked Questions

What is the IUPAC name of N-[1-methyl-6-(trifluoromethyl)piperidin-3-yl]-2-(tetrazol-1-yl)acetamide?
The IUPAC name of N-[1-methyl-6-(trifluoromethyl)piperidin-3-yl]-2-(tetrazol-1-yl)acetamide (CID 128981229) is N-[1-methyl-6-(trifluoromethyl)piperidin-3-yl]-2-(tetrazol-1-yl)acetamide.
What is the SMILES notation for N-[1-methyl-6-(trifluoromethyl)piperidin-3-yl]-2-(tetrazol-1-yl)acetamide?
The canonical SMILES for N-[1-methyl-6-(trifluoromethyl)piperidin-3-yl]-2-(tetrazol-1-yl)acetamide is CN1CC(NC(=O)Cn2cnnn2)CCC1C(F)(F)F.
What is the InChIKey of N-[1-methyl-6-(trifluoromethyl)piperidin-3-yl]-2-(tetrazol-1-yl)acetamide?
The InChIKey is TZIWWQXFBLGYJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15F3N6O/c1-18-4-7(2-3-8(18)10(11,12)13)15-9(20)5-19-6-14-16-17-19/h6-8H,2-5H2,1H3,(H,15,20).
What are the key properties of N-[1-methyl-6-(trifluoromethyl)piperidin-3-yl]-2-(tetrazol-1-yl)acetamide?
N-[1-methyl-6-(trifluoromethyl)piperidin-3-yl]-2-(tetrazol-1-yl)acetamide has a molecular weight of 292.27 g/mol, XLogP of -0.19, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-methyl-6-(trifluoromethyl)piperidin-3-yl]-2-(tetrazol-1-yl)acetamide is sourced from PubChem (CID 128981229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).