3-(4-ethoxy-2-methylphenyl)-N,N-dimethylpropan-1-amine

C14H23NO — CID 170866578

IUPAC3-(4-ethoxy-2-methylphenyl)-N,N-dimethylpropan-1-amine
SMILESCCOc1ccc(CCCN(C)C)c(C)c1
InChIInChI=1S/C14H23NO/c1-5-16-14-9-8-13(12(2)11-14)7-6-10-15(3)4/h8-9,11H,5-7,10H2,1-4H3
InChIKeyILENXWGQANFPRJ-UHFFFAOYSA-N
MW221.34 g/mol
LogP2.89
Rot. Bonds6

About 3-(4-ethoxy-2-methylphenyl)-N,N-dimethylpropan-1-amine

3-(4-ethoxy-2-methylphenyl)-N,N-dimethylpropan-1-amine (PubChem CID 170866578) has the molecular formula C14H23NO and a molecular weight of 221.34 g/mol. Its IUPAC name is 3-(4-ethoxy-2-methylphenyl)-N,N-dimethylpropan-1-amine.

Molecular Properties

Compound Name3-(4-ethoxy-2-methylphenyl)-N,N-dimethylpropan-1-amine
PubChem CID170866578
Molecular FormulaC14H23NO
Molecular Weight221.34 g/mol
Exact Mass221.18
IUPAC Name3-(4-ethoxy-2-methylphenyl)-N,N-dimethylpropan-1-amine
SMILESCCOc1ccc(CCCN(C)C)c(C)c1
InChIInChI=1S/C14H23NO/c1-5-16-14-9-8-13(12(2)11-14)7-6-10-15(3)4/h8-9,11H,5-7,10H2,1-4H3
InChIKeyILENXWGQANFPRJ-UHFFFAOYSA-N
XLogP2.89
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.34
LogP ≤ 52.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 3-(4-ethoxy-2-methylphenyl)-N,N-dimethylpropan-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

3-(4-ethoxy-2-methylphenyl)propane-1-thiol
CID 83798450
1-(4-ethoxy-2-methylphenyl)heptan-4-amine
CID 83936586
2-(4-ethyl-3-methylphenoxy)-N,N-dimethylethanamine
CID 163472505
3-(3-ethoxyphenyl)-N,N-dimethylpropan-1-amine
CID 170865322
(4-ethoxy-2-methylphenyl)methanethiol
CID 83798448
4-ethoxy-2-methyl-1-[(Z)-pent-3-enyl]benzene
CID 83936665
1-[3-(4-ethoxy-2-methylphenyl)propyl]piperazine
CID 83936615
2-(3,4-dimethylphenoxy)-N,N-dimethylethanamine
CID 82075858
3-(4-ethoxy-3,5-dimethylphenyl)-N,N-dimethylpropan-1-amine
CID 170866561
5-[6-[4-[3-(dimethylamino)propoxy]-2-methylphenyl]hexyl]-6-methylpyrimidine-2,4-diamine
CID 142789375
1-[3-(2,4-dimethoxyphenyl)propyl]-4-ethoxy-2-methoxybenzene
CID 139826457
2-(3-bromopropyl)-4-ethoxy-1-methylbenzene
CID 118836441

Frequently Asked Questions

What is the IUPAC name of 3-(4-ethoxy-2-methylphenyl)-N,N-dimethylpropan-1-amine?
The IUPAC name of 3-(4-ethoxy-2-methylphenyl)-N,N-dimethylpropan-1-amine (CID 170866578) is 3-(4-ethoxy-2-methylphenyl)-N,N-dimethylpropan-1-amine.
What is the SMILES notation for 3-(4-ethoxy-2-methylphenyl)-N,N-dimethylpropan-1-amine?
The canonical SMILES for 3-(4-ethoxy-2-methylphenyl)-N,N-dimethylpropan-1-amine is CCOc1ccc(CCCN(C)C)c(C)c1.
What is the InChIKey of 3-(4-ethoxy-2-methylphenyl)-N,N-dimethylpropan-1-amine?
The InChIKey is ILENXWGQANFPRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO/c1-5-16-14-9-8-13(12(2)11-14)7-6-10-15(3)4/h8-9,11H,5-7,10H2,1-4H3.
What are the key properties of 3-(4-ethoxy-2-methylphenyl)-N,N-dimethylpropan-1-amine?
3-(4-ethoxy-2-methylphenyl)-N,N-dimethylpropan-1-amine has a molecular weight of 221.34 g/mol, XLogP of 2.89, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-ethoxy-2-methylphenyl)-N,N-dimethylpropan-1-amine is sourced from PubChem (CID 170866578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).