3-(3-cyclobutyloxyphenyl)butan-1-amine

C14H21NO — CID 117313284

IUPAC3-(3-cyclobutyloxyphenyl)butan-1-amine
SMILESCC(CCN)c1cccc(OC2CCC2)c1
InChIInChI=1S/C14H21NO/c1-11(8-9-15)12-4-2-7-14(10-12)16-13-5-3-6-13/h2,4,7,10-11,13H,3,5-6,8-9,15H2,1H3
InChIKeyDXKNTDXEJFLUDJ-UHFFFAOYSA-N
MW219.33 g/mol
LogP3.07
Rot. Bonds5

About 3-(3-cyclobutyloxyphenyl)butan-1-amine

3-(3-cyclobutyloxyphenyl)butan-1-amine (PubChem CID 117313284) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 3-(3-cyclobutyloxyphenyl)butan-1-amine.

Molecular Properties

Compound Name3-(3-cyclobutyloxyphenyl)butan-1-amine
PubChem CID117313284
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name3-(3-cyclobutyloxyphenyl)butan-1-amine
SMILESCC(CCN)c1cccc(OC2CCC2)c1
InChIInChI=1S/C14H21NO/c1-11(8-9-15)12-4-2-7-14(10-12)16-13-5-3-6-13/h2,4,7,10-11,13H,3,5-6,8-9,15H2,1H3
InChIKeyDXKNTDXEJFLUDJ-UHFFFAOYSA-N
XLogP3.07
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-(3-cyclobutyloxyphenyl)butan-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

1-cyclopentyloxy-3-propan-2-ylbenzene
CID 140909564
(1R)-1-(3-cyclopentyloxyphenyl)ethane-1,2-diamine
CID 66517730
5-amino-N-[1-(3-cyclopentyloxyphenyl)ethyl]pentane-1-sulfonamide
CID 155346979
2-amino-1-(3-cyclohexyloxyphenyl)ethanol
CID 83824323
(1R)-1-(3-cyclopentyloxyphenyl)-N-ethylethanamine
CID 93007530
1-(3-cyclopentyloxyphenyl)propan-2-amine;hydrochloride
CID 54592852
[1-(3-cyclopropyloxyphenyl)-4-methylpentyl]hydrazine
CID 105207737
2-(3-cyclopentyloxyphenyl)ethanamine;hydrochloride
CID 155896532
2-[3-(1-methylpiperidin-4-yl)oxyphenyl]propan-1-ol
CID 117377386
N-[1-(3-cyclopentyloxyphenyl)ethyl]butan-2-amine
CID 132649569
[1-(3-cyclopropyloxyphenyl)-3-methylbutyl]hydrazine
CID 105199146
3-(3-propan-2-ylphenoxy)cyclohexan-1-ol
CID 79618801

Frequently Asked Questions

What is the IUPAC name of 3-(3-cyclobutyloxyphenyl)butan-1-amine?
The IUPAC name of 3-(3-cyclobutyloxyphenyl)butan-1-amine (CID 117313284) is 3-(3-cyclobutyloxyphenyl)butan-1-amine.
What is the SMILES notation for 3-(3-cyclobutyloxyphenyl)butan-1-amine?
The canonical SMILES for 3-(3-cyclobutyloxyphenyl)butan-1-amine is CC(CCN)c1cccc(OC2CCC2)c1.
What is the InChIKey of 3-(3-cyclobutyloxyphenyl)butan-1-amine?
The InChIKey is DXKNTDXEJFLUDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-11(8-9-15)12-4-2-7-14(10-12)16-13-5-3-6-13/h2,4,7,10-11,13H,3,5-6,8-9,15H2,1H3.
What are the key properties of 3-(3-cyclobutyloxyphenyl)butan-1-amine?
3-(3-cyclobutyloxyphenyl)butan-1-amine has a molecular weight of 219.33 g/mol, XLogP of 3.07, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-cyclobutyloxyphenyl)butan-1-amine is sourced from PubChem (CID 117313284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).