2-(1-aminocyclobutyl)-1-(2-methyltetrazol-5-yl)ethanone

C8H13N5O — CID 130909624

IUPAC2-(1-aminocyclobutyl)-1-(2-methyltetrazol-5-yl)ethanone
SMILESCn1nnc(C(=O)CC2(N)CCC2)n1
InChIInChI=1S/C8H13N5O/c1-13-11-7(10-12-13)6(14)5-8(9)3-2-4-8/h2-5,9H2,1H3
InChIKeyFPMLDLZVGSQPGR-UHFFFAOYSA-N
MW195.23 g/mol
LogP-0.34
Rot. Bonds3

About 2-(1-aminocyclobutyl)-1-(2-methyltetrazol-5-yl)ethanone

2-(1-aminocyclobutyl)-1-(2-methyltetrazol-5-yl)ethanone (PubChem CID 130909624) has the molecular formula C8H13N5O and a molecular weight of 195.23 g/mol. Its IUPAC name is 2-(1-aminocyclobutyl)-1-(2-methyltetrazol-5-yl)ethanone.

Molecular Properties

Compound Name2-(1-aminocyclobutyl)-1-(2-methyltetrazol-5-yl)ethanone
PubChem CID130909624
Molecular FormulaC8H13N5O
Molecular Weight195.23 g/mol
Exact Mass195.11
IUPAC Name2-(1-aminocyclobutyl)-1-(2-methyltetrazol-5-yl)ethanone
SMILESCn1nnc(C(=O)CC2(N)CCC2)n1
InChIInChI=1S/C8H13N5O/c1-13-11-7(10-12-13)6(14)5-8(9)3-2-4-8/h2-5,9H2,1H3
InChIKeyFPMLDLZVGSQPGR-UHFFFAOYSA-N
XLogP-0.34
TPSA86.69 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.23
LogP ≤ 5-0.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-(1-aminocyclobutyl)-1-(2-methyltetrazol-5-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

Frequently Asked Questions

What is the IUPAC name of 2-(1-aminocyclobutyl)-1-(2-methyltetrazol-5-yl)ethanone?
The IUPAC name of 2-(1-aminocyclobutyl)-1-(2-methyltetrazol-5-yl)ethanone (CID 130909624) is 2-(1-aminocyclobutyl)-1-(2-methyltetrazol-5-yl)ethanone.
What is the SMILES notation for 2-(1-aminocyclobutyl)-1-(2-methyltetrazol-5-yl)ethanone?
The canonical SMILES for 2-(1-aminocyclobutyl)-1-(2-methyltetrazol-5-yl)ethanone is Cn1nnc(C(=O)CC2(N)CCC2)n1.
What is the InChIKey of 2-(1-aminocyclobutyl)-1-(2-methyltetrazol-5-yl)ethanone?
The InChIKey is FPMLDLZVGSQPGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N5O/c1-13-11-7(10-12-13)6(14)5-8(9)3-2-4-8/h2-5,9H2,1H3.
What are the key properties of 2-(1-aminocyclobutyl)-1-(2-methyltetrazol-5-yl)ethanone?
2-(1-aminocyclobutyl)-1-(2-methyltetrazol-5-yl)ethanone has a molecular weight of 195.23 g/mol, XLogP of -0.34, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-aminocyclobutyl)-1-(2-methyltetrazol-5-yl)ethanone is sourced from PubChem (CID 130909624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).