3-(5-ethyltetrazol-2-yl)cyclopentane-1,2-diol

C8H14N4O2 — CID 142697768

IUPAC3-(5-ethyltetrazol-2-yl)cyclopentane-1,2-diol
SMILESCCc1nnn(C2CCC(O)C2O)n1
InChIInChI=1S/C8H14N4O2/c1-2-7-9-11-12(10-7)5-3-4-6(13)8(5)14/h5-6,8,13-14H,2-4H2,1H3
InChIKeyKAMZWDVWWNHFRK-UHFFFAOYSA-N
MW198.23 g/mol
LogP-0.71
Rot. Bonds2

About 3-(5-ethyltetrazol-2-yl)cyclopentane-1,2-diol

3-(5-ethyltetrazol-2-yl)cyclopentane-1,2-diol (PubChem CID 142697768) has the molecular formula C8H14N4O2 and a molecular weight of 198.23 g/mol. Its IUPAC name is 3-(5-ethyltetrazol-2-yl)cyclopentane-1,2-diol.

Molecular Properties

Compound Name3-(5-ethyltetrazol-2-yl)cyclopentane-1,2-diol
PubChem CID142697768
Molecular FormulaC8H14N4O2
Molecular Weight198.23 g/mol
Exact Mass198.11
IUPAC Name3-(5-ethyltetrazol-2-yl)cyclopentane-1,2-diol
SMILESCCc1nnn(C2CCC(O)C2O)n1
InChIInChI=1S/C8H14N4O2/c1-2-7-9-11-12(10-7)5-3-4-6(13)8(5)14/h5-6,8,13-14H,2-4H2,1H3
InChIKeyKAMZWDVWWNHFRK-UHFFFAOYSA-N
XLogP-0.71
TPSA84.06 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.23
LogP ≤ 5-0.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3-(5-ethyltetrazol-2-yl)cyclopentane-1,2-diol?
The IUPAC name of 3-(5-ethyltetrazol-2-yl)cyclopentane-1,2-diol (CID 142697768) is 3-(5-ethyltetrazol-2-yl)cyclopentane-1,2-diol.
What is the SMILES notation for 3-(5-ethyltetrazol-2-yl)cyclopentane-1,2-diol?
The canonical SMILES for 3-(5-ethyltetrazol-2-yl)cyclopentane-1,2-diol is CCc1nnn(C2CCC(O)C2O)n1.
What is the InChIKey of 3-(5-ethyltetrazol-2-yl)cyclopentane-1,2-diol?
The InChIKey is KAMZWDVWWNHFRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4O2/c1-2-7-9-11-12(10-7)5-3-4-6(13)8(5)14/h5-6,8,13-14H,2-4H2,1H3.
What are the key properties of 3-(5-ethyltetrazol-2-yl)cyclopentane-1,2-diol?
3-(5-ethyltetrazol-2-yl)cyclopentane-1,2-diol has a molecular weight of 198.23 g/mol, XLogP of -0.71, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-ethyltetrazol-2-yl)cyclopentane-1,2-diol is sourced from PubChem (CID 142697768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).