1-[1-(3-ethoxy-2,2-dimethylcyclobutyl)tetrazol-5-yl]ethanamine

C11H21N5O — CID 114120256

IUPAC1-[1-(3-ethoxy-2,2-dimethylcyclobutyl)tetrazol-5-yl]ethanamine
SMILESCCOC1CC(n2nnnc2C(C)N)C1(C)C
InChIInChI=1S/C11H21N5O/c1-5-17-9-6-8(11(9,3)4)16-10(7(2)12)13-14-15-16/h7-9H,5-6,12H2,1-4H3
InChIKeyAOMDEFLWGCUJIU-UHFFFAOYSA-N
MW239.32 g/mol
LogP1.07
Rot. Bonds4

About 1-[1-(3-ethoxy-2,2-dimethylcyclobutyl)tetrazol-5-yl]ethanamine

1-[1-(3-ethoxy-2,2-dimethylcyclobutyl)tetrazol-5-yl]ethanamine (PubChem CID 114120256) has the molecular formula C11H21N5O and a molecular weight of 239.32 g/mol. Its IUPAC name is 1-[1-(3-ethoxy-2,2-dimethylcyclobutyl)tetrazol-5-yl]ethanamine.

Molecular Properties

Compound Name1-[1-(3-ethoxy-2,2-dimethylcyclobutyl)tetrazol-5-yl]ethanamine
PubChem CID114120256
Molecular FormulaC11H21N5O
Molecular Weight239.32 g/mol
Exact Mass239.17
IUPAC Name1-[1-(3-ethoxy-2,2-dimethylcyclobutyl)tetrazol-5-yl]ethanamine
SMILESCCOC1CC(n2nnnc2C(C)N)C1(C)C
InChIInChI=1S/C11H21N5O/c1-5-17-9-6-8(11(9,3)4)16-10(7(2)12)13-14-15-16/h7-9H,5-6,12H2,1-4H3
InChIKeyAOMDEFLWGCUJIU-UHFFFAOYSA-N
XLogP1.07
TPSA78.85 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 1-[1-(3-ethoxy-2,2-dimethylcyclobutyl)tetrazol-5-yl]ethanamine 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

2-[1-(3-ethoxy-2,2-dimethylcyclobutyl)tetrazol-5-yl]sulfanylacetic acid
CID 114119961
1-(3-ethoxy-2,2-dimethylcyclobutyl)ethanol
CID 130713079
1-(1-methyltetrazol-5-yl)ethanamine
CID 75355753
cis-(1S,3R)-3-ethoxy-2,2-dimethylcyclobutan-1-ol
CID 95240890
N-(2-methoxyethyl)-1-[1-(2,2,3,3-tetramethylcyclopropyl)tetrazol-5-yl]ethanamine
CID 103086509
2-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]-4-methylpentanoic acid
CID 64853101
3-amino-N-(3-ethoxy-2,2-dimethylcyclobutyl)-N-methylbutanamide;hydrochloride
CID 119799255
N-ethyl-1-[1-(3-methylcyclobutyl)tetrazol-5-yl]ethanamine
CID 103086857
[1-(2-methyl-2-propan-2-ylcyclopropyl)tetrazol-5-yl]methanamine
CID 130871011
1-(3-ethoxy-2,2-dimethylcyclobutyl)-2-ethylguanidine
CID 103734487
4-amino-N-(3-ethoxy-2,2-dimethylcyclobutyl)-2-methylbutanamide
CID 114119108
5-(1-chloroethyl)-1-(3-ethylcyclohexyl)tetrazole
CID 103084562

Frequently Asked Questions

What is the IUPAC name of 1-[1-(3-ethoxy-2,2-dimethylcyclobutyl)tetrazol-5-yl]ethanamine?
The IUPAC name of 1-[1-(3-ethoxy-2,2-dimethylcyclobutyl)tetrazol-5-yl]ethanamine (CID 114120256) is 1-[1-(3-ethoxy-2,2-dimethylcyclobutyl)tetrazol-5-yl]ethanamine.
What is the SMILES notation for 1-[1-(3-ethoxy-2,2-dimethylcyclobutyl)tetrazol-5-yl]ethanamine?
The canonical SMILES for 1-[1-(3-ethoxy-2,2-dimethylcyclobutyl)tetrazol-5-yl]ethanamine is CCOC1CC(n2nnnc2C(C)N)C1(C)C.
What is the InChIKey of 1-[1-(3-ethoxy-2,2-dimethylcyclobutyl)tetrazol-5-yl]ethanamine?
The InChIKey is AOMDEFLWGCUJIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N5O/c1-5-17-9-6-8(11(9,3)4)16-10(7(2)12)13-14-15-16/h7-9H,5-6,12H2,1-4H3.
What are the key properties of 1-[1-(3-ethoxy-2,2-dimethylcyclobutyl)tetrazol-5-yl]ethanamine?
1-[1-(3-ethoxy-2,2-dimethylcyclobutyl)tetrazol-5-yl]ethanamine has a molecular weight of 239.32 g/mol, XLogP of 1.07, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(3-ethoxy-2,2-dimethylcyclobutyl)tetrazol-5-yl]ethanamine is sourced from PubChem (CID 114120256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).