3-ethoxy-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)cyclobutan-1-amine

C17H25NO — CID 103917323

IUPAC3-ethoxy-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)cyclobutan-1-amine
SMILESCCOC1CC(NCC2CCCc3ccccc32)C1
InChIInChI=1S/C17H25NO/c1-2-19-16-10-15(11-16)18-12-14-8-5-7-13-6-3-4-9-17(13)14/h3-4,6,9,14-16,18H,2,5,7-8,10-12H2,1H3
InChIKeyINYCJMOOELTBMV-UHFFFAOYSA-N
MW259.39 g/mol
LogP3.26
Rot. Bonds5

About 3-ethoxy-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)cyclobutan-1-amine

3-ethoxy-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)cyclobutan-1-amine (PubChem CID 103917323) has the molecular formula C17H25NO and a molecular weight of 259.39 g/mol. Its IUPAC name is 3-ethoxy-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)cyclobutan-1-amine.

Molecular Properties

Compound Name3-ethoxy-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)cyclobutan-1-amine
PubChem CID103917323
Molecular FormulaC17H25NO
Molecular Weight259.39 g/mol
Exact Mass259.19
IUPAC Name3-ethoxy-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)cyclobutan-1-amine
SMILESCCOC1CC(NCC2CCCc3ccccc32)C1
InChIInChI=1S/C17H25NO/c1-2-19-16-10-15(11-16)18-12-14-8-5-7-13-6-3-4-9-17(13)14/h3-4,6,9,14-16,18H,2,5,7-8,10-12H2,1H3
InChIKeyINYCJMOOELTBMV-UHFFFAOYSA-N
XLogP3.26
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.39
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-ethoxy-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)cyclobutan-1-amine 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

2,4-dimethyl-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)cyclohexan-1-amine
CID 63994320
2,3-dimethyl-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)cyclohexan-1-amine
CID 63772601
1-(2-methylpropyl)-1,2,3,4-tetrahydronaphthalene
CID 54453127
(1R)-1-cyclohexyl-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)ethanamine
CID 81384440
N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)prop-2-yn-1-amine
CID 63770878
1-[2-(1,2,3,4-tetrahydronaphthalen-1-yl)ethyl]-1,2,3,4-tetrahydronaphthalene
CID 15742901
N-[(2-ethylphenyl)methyl]-1-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine
CID 64681155
methyl 2-(1,2,3,4-tetrahydronaphthalen-1-ylmethylamino)acetate
CID 63771406
2-bromo-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)ethanamine
CID 114505328
4-ethoxy-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)benzamide
CID 46578689
6-(1,2,3,4-tetrahydronaphthalen-1-ylmethylamino)hexan-1-ol
CID 107851787
N-phenylmethoxy-1-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine
CID 64974310

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)cyclobutan-1-amine?
The IUPAC name of 3-ethoxy-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)cyclobutan-1-amine (CID 103917323) is 3-ethoxy-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)cyclobutan-1-amine.
What is the SMILES notation for 3-ethoxy-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)cyclobutan-1-amine?
The canonical SMILES for 3-ethoxy-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)cyclobutan-1-amine is CCOC1CC(NCC2CCCc3ccccc32)C1.
What is the InChIKey of 3-ethoxy-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)cyclobutan-1-amine?
The InChIKey is INYCJMOOELTBMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO/c1-2-19-16-10-15(11-16)18-12-14-8-5-7-13-6-3-4-9-17(13)14/h3-4,6,9,14-16,18H,2,5,7-8,10-12H2,1H3.
What are the key properties of 3-ethoxy-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)cyclobutan-1-amine?
3-ethoxy-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)cyclobutan-1-amine has a molecular weight of 259.39 g/mol, XLogP of 3.26, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)cyclobutan-1-amine is sourced from PubChem (CID 103917323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).