4-[2-(dimethylamino)ethoxy]-N-(3-methylcyclobutyl)aniline

C15H24N2O — CID 104860156

IUPAC4-[2-(dimethylamino)ethoxy]-N-(3-methylcyclobutyl)aniline
SMILESCC1CC(Nc2ccc(OCCN(C)C)cc2)C1
InChIInChI=1S/C15H24N2O/c1-12-10-14(11-12)16-13-4-6-15(7-5-13)18-9-8-17(2)3/h4-7,12,14,16H,8-11H2,1-3H3
InChIKeySAMLGSGUMXUWJR-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.84
Rot. Bonds6

About 4-[2-(dimethylamino)ethoxy]-N-(3-methylcyclobutyl)aniline

4-[2-(dimethylamino)ethoxy]-N-(3-methylcyclobutyl)aniline (PubChem CID 104860156) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 4-[2-(dimethylamino)ethoxy]-N-(3-methylcyclobutyl)aniline.

Molecular Properties

Compound Name4-[2-(dimethylamino)ethoxy]-N-(3-methylcyclobutyl)aniline
PubChem CID104860156
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name4-[2-(dimethylamino)ethoxy]-N-(3-methylcyclobutyl)aniline
SMILESCC1CC(Nc2ccc(OCCN(C)C)cc2)C1
InChIInChI=1S/C15H24N2O/c1-12-10-14(11-12)16-13-4-6-15(7-5-13)18-9-8-17(2)3/h4-7,12,14,16H,8-11H2,1-3H3
InChIKeySAMLGSGUMXUWJR-UHFFFAOYSA-N
XLogP2.84
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}

Analyze 4-[2-(dimethylamino)ethoxy]-N-(3-methylcyclobutyl)aniline 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

N-[4-[2-(dimethylamino)ethoxy]phenyl]thian-4-amine
CID 54863930
4-[4-[2-(dimethylamino)ethoxy]anilino]cyclohexan-1-ol
CID 82539341
4-N-[4-[2-(dimethylamino)ethoxy]phenyl]cyclohexane-1,4-diamine
CID 79731299
4-[2-(dimethylamino)ethoxy]-N-(3-ethylcyclopentyl)aniline
CID 64502151
4-ethoxy-N-(3-methylcyclobutyl)aniline
CID 104859963
4-[2-(dimethylamino)ethoxy]-N-(2-methylcyclopentyl)aniline
CID 65046094
4-[2-(dimethylamino)ethoxy]-N-(2-methylcyclohexyl)aniline
CID 60943035
2-[4-[(3-methylcyclobutyl)amino]phenoxy]acetamide
CID 104860036
1-N-[3-[2-(dimethylamino)ethoxy]phenyl]cyclobutane-1,3-diamine
CID 80559817
N-(3-methylcyclobutyl)-4-propan-2-yloxyaniline
CID 104860033
1-N-[4-(2-methoxyethoxy)phenyl]cyclobutane-1,3-diamine
CID 80560810
4-amino-N-[4-[2-(dimethylamino)ethoxy]phenyl]cyclopent-2-ene-1-carboxamide
CID 79209286

Frequently Asked Questions

What is the IUPAC name of 4-[2-(dimethylamino)ethoxy]-N-(3-methylcyclobutyl)aniline?
The IUPAC name of 4-[2-(dimethylamino)ethoxy]-N-(3-methylcyclobutyl)aniline (CID 104860156) is 4-[2-(dimethylamino)ethoxy]-N-(3-methylcyclobutyl)aniline.
What is the SMILES notation for 4-[2-(dimethylamino)ethoxy]-N-(3-methylcyclobutyl)aniline?
The canonical SMILES for 4-[2-(dimethylamino)ethoxy]-N-(3-methylcyclobutyl)aniline is CC1CC(Nc2ccc(OCCN(C)C)cc2)C1.
What is the InChIKey of 4-[2-(dimethylamino)ethoxy]-N-(3-methylcyclobutyl)aniline?
The InChIKey is SAMLGSGUMXUWJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-12-10-14(11-12)16-13-4-6-15(7-5-13)18-9-8-17(2)3/h4-7,12,14,16H,8-11H2,1-3H3.
What are the key properties of 4-[2-(dimethylamino)ethoxy]-N-(3-methylcyclobutyl)aniline?
4-[2-(dimethylamino)ethoxy]-N-(3-methylcyclobutyl)aniline has a molecular weight of 248.37 g/mol, XLogP of 2.84, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(dimethylamino)ethoxy]-N-(3-methylcyclobutyl)aniline is sourced from PubChem (CID 104860156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).