2-(2-methyltetrazol-5-yl)-1-[5-(trifluoromethyl)-2-pyridinyl]ethanol

C10H10F3N5O — CID 107065711

IUPAC2-(2-methyltetrazol-5-yl)-1-[5-(trifluoromethyl)-2-pyridinyl]ethanol
SMILESCn1nnc(CC(O)c2ccc(C(F)(F)F)cn2)n1
InChIInChI=1S/C10H10F3N5O/c1-18-16-9(15-17-18)4-8(19)7-3-2-6(5-14-7)10(11,12)13/h2-3,5,8,19H,4H2,1H3
InChIKeySVDBWMLLOAKVOC-UHFFFAOYSA-N
MW273.22 g/mol
LogP0.90
Rot. Bonds3

About 2-(2-methyltetrazol-5-yl)-1-[5-(trifluoromethyl)-2-pyridinyl]ethanol

2-(2-methyltetrazol-5-yl)-1-[5-(trifluoromethyl)-2-pyridinyl]ethanol (PubChem CID 107065711) has the molecular formula C10H10F3N5O and a molecular weight of 273.22 g/mol. Its IUPAC name is 2-(2-methyltetrazol-5-yl)-1-[5-(trifluoromethyl)-2-pyridinyl]ethanol.

Molecular Properties

Compound Name2-(2-methyltetrazol-5-yl)-1-[5-(trifluoromethyl)-2-pyridinyl]ethanol
PubChem CID107065711
Molecular FormulaC10H10F3N5O
Molecular Weight273.22 g/mol
Exact Mass273.08
IUPAC Name2-(2-methyltetrazol-5-yl)-1-[5-(trifluoromethyl)-2-pyridinyl]ethanol
SMILESCn1nnc(CC(O)c2ccc(C(F)(F)F)cn2)n1
InChIInChI=1S/C10H10F3N5O/c1-18-16-9(15-17-18)4-8(19)7-3-2-6(5-14-7)10(11,12)13/h2-3,5,8,19H,4H2,1H3
InChIKeySVDBWMLLOAKVOC-UHFFFAOYSA-N
XLogP0.90
TPSA76.72 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.22
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-(2-methyltetrazol-5-yl)-1-[2-(trifluoromethyl)phenyl]ethanol
CID 107045890
1-(5-fluoro-2-pyridinyl)-2-(2-methyltetrazol-5-yl)ethanamine
CID 107050206
4-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]pent-4-en-1-ol
CID 105127410
bis[5-(trifluoromethyl)-2-pyridinyl]methanol
CID 170433737
2-[1-hydrazinyl-2-(2-methyltetrazol-5-yl)ethyl]-4-(trifluoromethyl)aniline
CID 107066373
[1-(2-methyltetrazol-5-yl)-3-[4-(trifluoromethyl)phenyl]propan-2-yl]hydrazine
CID 107066944
1-(3-fluoro-2-pyridinyl)-2-(2-methyltetrazol-5-yl)ethanol
CID 107048053
2-(5-bromothiophen-2-yl)-1-[5-(trifluoromethyl)-2-pyridinyl]ethanol
CID 105087304
2-(2-chloro-4-methylphenyl)-1-[5-(trifluoromethyl)-2-pyridinyl]ethanol
CID 106867992
2-(3-bromo-4-fluorophenyl)-1-[5-(trifluoromethyl)-2-pyridinyl]ethanol
CID 105082327
2-(2,4-dichlorophenyl)-1-[5-(trifluoromethyl)-2-pyridinyl]ethanol
CID 105086791
2-(4-bromo-2-fluorophenyl)-1-[5-(trifluoromethyl)-2-pyridinyl]ethanol
CID 105089225

Frequently Asked Questions

What is the IUPAC name of 2-(2-methyltetrazol-5-yl)-1-[5-(trifluoromethyl)-2-pyridinyl]ethanol?
The IUPAC name of 2-(2-methyltetrazol-5-yl)-1-[5-(trifluoromethyl)-2-pyridinyl]ethanol (CID 107065711) is 2-(2-methyltetrazol-5-yl)-1-[5-(trifluoromethyl)-2-pyridinyl]ethanol.
What is the SMILES notation for 2-(2-methyltetrazol-5-yl)-1-[5-(trifluoromethyl)-2-pyridinyl]ethanol?
The canonical SMILES for 2-(2-methyltetrazol-5-yl)-1-[5-(trifluoromethyl)-2-pyridinyl]ethanol is Cn1nnc(CC(O)c2ccc(C(F)(F)F)cn2)n1.
What is the InChIKey of 2-(2-methyltetrazol-5-yl)-1-[5-(trifluoromethyl)-2-pyridinyl]ethanol?
The InChIKey is SVDBWMLLOAKVOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F3N5O/c1-18-16-9(15-17-18)4-8(19)7-3-2-6(5-14-7)10(11,12)13/h2-3,5,8,19H,4H2,1H3.
What are the key properties of 2-(2-methyltetrazol-5-yl)-1-[5-(trifluoromethyl)-2-pyridinyl]ethanol?
2-(2-methyltetrazol-5-yl)-1-[5-(trifluoromethyl)-2-pyridinyl]ethanol has a molecular weight of 273.22 g/mol, XLogP of 0.90, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methyltetrazol-5-yl)-1-[5-(trifluoromethyl)-2-pyridinyl]ethanol is sourced from PubChem (CID 107065711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).