2-(5-pyridin-4-yltetrazol-2-yl)ethanol

C8H9N5O — CID 10559608

IUPAC2-(5-pyridin-4-yltetrazol-2-yl)ethanol
SMILESOCCn1nnc(-c2ccncc2)n1
InChIInChI=1S/C8H9N5O/c14-6-5-13-11-8(10-12-13)7-1-3-9-4-2-7/h1-4,14H,5-6H2
InChIKeyPANKYZMTKOOPLG-UHFFFAOYSA-N
MW191.19 g/mol
LogP-0.27
Rot. Bonds3

About 2-(5-pyridin-4-yltetrazol-2-yl)ethanol

2-(5-pyridin-4-yltetrazol-2-yl)ethanol (PubChem CID 10559608) has the molecular formula C8H9N5O and a molecular weight of 191.19 g/mol. Its IUPAC name is 2-(5-pyridin-4-yltetrazol-2-yl)ethanol.

Molecular Properties

Compound Name2-(5-pyridin-4-yltetrazol-2-yl)ethanol
PubChem CID10559608
Molecular FormulaC8H9N5O
Molecular Weight191.19 g/mol
Exact Mass191.08
IUPAC Name2-(5-pyridin-4-yltetrazol-2-yl)ethanol
SMILESOCCn1nnc(-c2ccncc2)n1
InChIInChI=1S/C8H9N5O/c14-6-5-13-11-8(10-12-13)7-1-3-9-4-2-7/h1-4,14H,5-6H2
InChIKeyPANKYZMTKOOPLG-UHFFFAOYSA-N
XLogP-0.27
TPSA76.72 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.19
LogP ≤ 5-0.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

3-(2H-tetrazol-5-yl)pyridine
CID 151091
5-(4-Pyridyl)-1H-Tetrazole
CID 482249
2-(3-pyridin-4-yl-4H-1,2,4-triazol-4-yl)butan-1-ol
CID 3235743
N-(3,5-dimethyl-4H-1,2,4-triazol-4-yl)-N-(3-pyridinylmethylene)amine
CID 6887464
4-[4-(2-hydroxyethyl)-5-(methylsulfanyl)-4H-1,2,4-triazol-3-yl]-1-methylpyridinium
CID 11731607
4-(4-methyl-4H-1,2,4-triazol-3-yl)pyridine
CID 21853004
3-(2-Phenyl-5-tetrazolyl)pyridine
CID 1215208
Pyridine, 4-[2-[2-[2-[5-(4-pyridinyl)-2H-1,2,3,4-tetrazol-2-yl]ethoxy]ethyl]-2H-1,2,3,4-tetrazol-5-yl]-
CID 4916819
3-((2H-tetrazol-5-yl)methyl)pyridine
CID 28602444
(5-Pyridin-4-yl-tetrazol-2-yl)-acetic acid
CID 3163494
2-[5-[4-[4-(Trifluoromethyl)anilino]pyridin-3-yl]tetrazol-2-yl]ethanol
CID 135371510
Pyridine, 3-[2-[(4-fluorophenyl)methyl]-2H-1,2,3,4-tetrazol-5-yl]-
CID 16763011

Frequently Asked Questions

What is the IUPAC name of 2-(5-pyridin-4-yltetrazol-2-yl)ethanol?
The IUPAC name of 2-(5-pyridin-4-yltetrazol-2-yl)ethanol (CID 10559608) is 2-(5-pyridin-4-yltetrazol-2-yl)ethanol.
What is the SMILES notation for 2-(5-pyridin-4-yltetrazol-2-yl)ethanol?
The canonical SMILES for 2-(5-pyridin-4-yltetrazol-2-yl)ethanol is OCCn1nnc(-c2ccncc2)n1.
What is the InChIKey of 2-(5-pyridin-4-yltetrazol-2-yl)ethanol?
The InChIKey is PANKYZMTKOOPLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N5O/c14-6-5-13-11-8(10-12-13)7-1-3-9-4-2-7/h1-4,14H,5-6H2.
What are the key properties of 2-(5-pyridin-4-yltetrazol-2-yl)ethanol?
2-(5-pyridin-4-yltetrazol-2-yl)ethanol has a molecular weight of 191.19 g/mol, XLogP of -0.27, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-pyridin-4-yltetrazol-2-yl)ethanol is sourced from PubChem (CID 10559608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).