N-ethyl-1-(3-ethylphenyl)-3-(2-methylphenyl)propan-1-amine

C20H27N — CID 105171234

IUPACN-ethyl-1-(3-ethylphenyl)-3-(2-methylphenyl)propan-1-amine
SMILESCCNC(CCc1ccccc1C)c1cccc(CC)c1
InChIInChI=1S/C20H27N/c1-4-17-10-8-12-19(15-17)20(21-5-2)14-13-18-11-7-6-9-16(18)3/h6-12,15,20-21H,4-5,13-14H2,1-3H3
InChIKeyMNWDBBZZWXPFDR-UHFFFAOYSA-N
MW281.44 g/mol
LogP4.84
Rot. Bonds7

About N-ethyl-1-(3-ethylphenyl)-3-(2-methylphenyl)propan-1-amine

N-ethyl-1-(3-ethylphenyl)-3-(2-methylphenyl)propan-1-amine (PubChem CID 105171234) has the molecular formula C20H27N and a molecular weight of 281.44 g/mol. Its IUPAC name is N-ethyl-1-(3-ethylphenyl)-3-(2-methylphenyl)propan-1-amine.

Molecular Properties

Compound NameN-ethyl-1-(3-ethylphenyl)-3-(2-methylphenyl)propan-1-amine
PubChem CID105171234
Molecular FormulaC20H27N
Molecular Weight281.44 g/mol
Exact Mass281.21
IUPAC NameN-ethyl-1-(3-ethylphenyl)-3-(2-methylphenyl)propan-1-amine
SMILESCCNC(CCc1ccccc1C)c1cccc(CC)c1
InChIInChI=1S/C20H27N/c1-4-17-10-8-12-19(15-17)20(21-5-2)14-13-18-11-7-6-9-16(18)3/h6-12,15,20-21H,4-5,13-14H2,1-3H3
InChIKeyMNWDBBZZWXPFDR-UHFFFAOYSA-N
XLogP4.84
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.44
LogP ≤ 54.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-ethyl-1-(3-ethylphenyl)-3-(2-methylphenyl)propan-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

N-ethyl-3-(2-methylphenyl)-1-(4-methylphenyl)propan-1-amine
CID 105092556
N-ethyl-1-(3-ethylphenyl)-3-pyridin-3-ylpropan-1-amine
CID 105171233
N-ethyl-1-(3-ethylphenyl)-3-methylsulfanylpropan-1-amine
CID 105171168
1-(3-bromophenyl)-N-ethyl-3-phenylpropan-1-amine
CID 54919438
1-(2,5-dimethylphenyl)-N-ethyl-3-(2-methylphenyl)propan-1-amine
CID 105120553
1-(4-bromo-3-methylphenyl)-N-ethyl-3-phenylpropan-1-amine
CID 115793778
N-ethyl-3-(3-methoxyphenyl)-1-phenylpropan-1-amine
CID 60996666
N-ethyl-1-(3-fluorophenyl)-4-(2-methylphenyl)butan-2-amine
CID 62367606
[1-(4-ethylphenyl)-3-(2-methylphenyl)propyl]hydrazine
CID 105292804
N-ethyl-1-(3-methylphenyl)-4-phenylbutan-1-amine
CID 63413344
N-ethyl-3-(3-fluoro-4-methylphenyl)-1-phenylpropan-1-amine
CID 107129437
1-(3-chlorophenyl)-N-ethyl-3-(4-methylphenyl)propan-1-amine
CID 105106501

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(3-ethylphenyl)-3-(2-methylphenyl)propan-1-amine?
The IUPAC name of N-ethyl-1-(3-ethylphenyl)-3-(2-methylphenyl)propan-1-amine (CID 105171234) is N-ethyl-1-(3-ethylphenyl)-3-(2-methylphenyl)propan-1-amine.
What is the SMILES notation for N-ethyl-1-(3-ethylphenyl)-3-(2-methylphenyl)propan-1-amine?
The canonical SMILES for N-ethyl-1-(3-ethylphenyl)-3-(2-methylphenyl)propan-1-amine is CCNC(CCc1ccccc1C)c1cccc(CC)c1.
What is the InChIKey of N-ethyl-1-(3-ethylphenyl)-3-(2-methylphenyl)propan-1-amine?
The InChIKey is MNWDBBZZWXPFDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N/c1-4-17-10-8-12-19(15-17)20(21-5-2)14-13-18-11-7-6-9-16(18)3/h6-12,15,20-21H,4-5,13-14H2,1-3H3.
What are the key properties of N-ethyl-1-(3-ethylphenyl)-3-(2-methylphenyl)propan-1-amine?
N-ethyl-1-(3-ethylphenyl)-3-(2-methylphenyl)propan-1-amine has a molecular weight of 281.44 g/mol, XLogP of 4.84, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(3-ethylphenyl)-3-(2-methylphenyl)propan-1-amine is sourced from PubChem (CID 105171234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).