2-(2-methyltetrazol-5-yl)-1-(2,4,5-trimethyloxolan-3-yl)ethanone

C11H18N4O2 — CID 107063194

IUPAC2-(2-methyltetrazol-5-yl)-1-(2,4,5-trimethyloxolan-3-yl)ethanone
SMILESCC1OC(C)C(C(=O)Cc2nnn(C)n2)C1C
InChIInChI=1S/C11H18N4O2/c1-6-7(2)17-8(3)11(6)9(16)5-10-12-14-15(4)13-10/h6-8,11H,5H2,1-4H3
InChIKeySBECDGUMXVHVCJ-UHFFFAOYSA-N
MW238.29 g/mol
LogP0.38
Rot. Bonds3

About 2-(2-methyltetrazol-5-yl)-1-(2,4,5-trimethyloxolan-3-yl)ethanone

2-(2-methyltetrazol-5-yl)-1-(2,4,5-trimethyloxolan-3-yl)ethanone (PubChem CID 107063194) has the molecular formula C11H18N4O2 and a molecular weight of 238.29 g/mol. Its IUPAC name is 2-(2-methyltetrazol-5-yl)-1-(2,4,5-trimethyloxolan-3-yl)ethanone.

Molecular Properties

Compound Name2-(2-methyltetrazol-5-yl)-1-(2,4,5-trimethyloxolan-3-yl)ethanone
PubChem CID107063194
Molecular FormulaC11H18N4O2
Molecular Weight238.29 g/mol
Exact Mass238.14
IUPAC Name2-(2-methyltetrazol-5-yl)-1-(2,4,5-trimethyloxolan-3-yl)ethanone
SMILESCC1OC(C)C(C(=O)Cc2nnn(C)n2)C1C
InChIInChI=1S/C11H18N4O2/c1-6-7(2)17-8(3)11(6)9(16)5-10-12-14-15(4)13-10/h6-8,11H,5H2,1-4H3
InChIKeySBECDGUMXVHVCJ-UHFFFAOYSA-N
XLogP0.38
TPSA69.90 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 50.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2-(2-methyltetrazol-5-yl)-1-(2,4,5-trimethyloxolan-3-yl)ethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2-Ethyloxolan-3-yl)-2-(2-methyltetrazol-5-yl)ethanone
CID 105743941
1-(2-Methyltetrazol-5-yl)-3-(oxolan-2-yl)propan-2-one
CID 107046861
2-(2-Methyltetrazol-5-yl)-1-(7-oxabicyclo[2.2.1]heptan-2-yl)ethanone
CID 107047069
2-(2-Methyltetrazol-5-yl)-1-(oxolan-3-yl)ethanone
CID 107047127
2-(2-Methyltetrazol-5-yl)-1-(oxan-4-yl)ethanone
CID 107047130
2-(2-Methyltetrazol-5-yl)-1-(oxan-3-yl)ethanone
CID 107047134
1-(2-Methyltetrazol-5-yl)-3-(oxolan-3-yl)propan-2-one
CID 107047444
1-(3-Methyloxolan-2-yl)-2-(2-methyltetrazol-5-yl)ethanone
CID 107063208
1-(5-Methyloxolan-3-yl)-2-(2-methyltetrazol-5-yl)ethanone
CID 107063298
5-Methoxy-4-methyl-1-(2-methyltetrazol-5-yl)pentan-2-one
CID 107063425
1-(2-Methyloxolan-3-yl)-2-(2-methyltetrazol-5-yl)ethanone
CID 107063490
2-(2-Methyltetrazol-5-yl)-1-(3-oxabicyclo[3.1.0]hexan-6-yl)ethanone
CID 130764008

Frequently Asked Questions

What is the IUPAC name of 2-(2-methyltetrazol-5-yl)-1-(2,4,5-trimethyloxolan-3-yl)ethanone?
The IUPAC name of 2-(2-methyltetrazol-5-yl)-1-(2,4,5-trimethyloxolan-3-yl)ethanone (CID 107063194) is 2-(2-methyltetrazol-5-yl)-1-(2,4,5-trimethyloxolan-3-yl)ethanone.
What is the SMILES notation for 2-(2-methyltetrazol-5-yl)-1-(2,4,5-trimethyloxolan-3-yl)ethanone?
The canonical SMILES for 2-(2-methyltetrazol-5-yl)-1-(2,4,5-trimethyloxolan-3-yl)ethanone is CC1OC(C)C(C(=O)Cc2nnn(C)n2)C1C.
What is the InChIKey of 2-(2-methyltetrazol-5-yl)-1-(2,4,5-trimethyloxolan-3-yl)ethanone?
The InChIKey is SBECDGUMXVHVCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O2/c1-6-7(2)17-8(3)11(6)9(16)5-10-12-14-15(4)13-10/h6-8,11H,5H2,1-4H3.
What are the key properties of 2-(2-methyltetrazol-5-yl)-1-(2,4,5-trimethyloxolan-3-yl)ethanone?
2-(2-methyltetrazol-5-yl)-1-(2,4,5-trimethyloxolan-3-yl)ethanone has a molecular weight of 238.29 g/mol, XLogP of 0.38, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methyltetrazol-5-yl)-1-(2,4,5-trimethyloxolan-3-yl)ethanone is sourced from PubChem (CID 107063194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).