2-ethyl-N-(3-methoxy-2-methylpropyl)-6-methylaniline

C14H23NO — CID 116501156

IUPAC2-ethyl-N-(3-methoxy-2-methylpropyl)-6-methylaniline
SMILESCCc1cccc(C)c1NCC(C)COC
InChIInChI=1S/C14H23NO/c1-5-13-8-6-7-12(3)14(13)15-9-11(2)10-16-4/h6-8,11,15H,5,9-10H2,1-4H3
InChIKeyCABVEFWTPTWUJC-UHFFFAOYSA-N
MW221.34 g/mol
LogP3.25
Rot. Bonds6

About 2-ethyl-N-(3-methoxy-2-methylpropyl)-6-methylaniline

2-ethyl-N-(3-methoxy-2-methylpropyl)-6-methylaniline (PubChem CID 116501156) has the molecular formula C14H23NO and a molecular weight of 221.34 g/mol. Its IUPAC name is 2-ethyl-N-(3-methoxy-2-methylpropyl)-6-methylaniline.

Molecular Properties

Compound Name2-ethyl-N-(3-methoxy-2-methylpropyl)-6-methylaniline
PubChem CID116501156
Molecular FormulaC14H23NO
Molecular Weight221.34 g/mol
Exact Mass221.18
IUPAC Name2-ethyl-N-(3-methoxy-2-methylpropyl)-6-methylaniline
SMILESCCc1cccc(C)c1NCC(C)COC
InChIInChI=1S/C14H23NO/c1-5-13-8-6-7-12(3)14(13)15-9-11(2)10-16-4/h6-8,11,15H,5,9-10H2,1-4H3
InChIKeyCABVEFWTPTWUJC-UHFFFAOYSA-N
XLogP3.25
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.34
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-ethyl-N-(3-methoxy-2-methylpropyl)-6-methylaniline 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-(2,4-dimethylpentyl)-2-ethyl-6-methylaniline
CID 114200632
2-[(3-methoxy-2-methylpropyl)amino]-3-methylbenzenecarbothioamide
CID 107108165
N'-(2-ethyl-6-methylphenyl)-N-(2-methoxyethyl)ethane-1,2-diamine
CID 54809654
2-chloro-N-(2-ethyl-6-methylphenyl)-4-methoxy-3-methylbutanamide
CID 70010696
2,6-diethyl-N-(1-methoxypropan-2-yl)aniline
CID 15051296
N-(2-ethyl-6-methylphenyl)-1-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine
CID 106555375
2-[[(3-methoxy-2-methylpropyl)amino]methyl]-6-methylphenol
CID 112554372
N-(3-methoxy-2-methylpropyl)-4-methyl-1,3-benzothiazol-2-amine
CID 79146599
2-bromo-6-fluoro-N-(3-methoxy-2-methylpropyl)aniline
CID 107598486
2-ethyl-N-(1-methoxypropan-2-yl)-6-methylaniline;N-(2-ethyl-6-methylphenyl)-1-methoxypropan-2-imine;molecular hydrogen
CID 158531933
N-(1-methoxypropan-2-yl)-2,6-dimethylaniline
CID 10899497
2,6-dimethyl-N-(2-methylpentyl)aniline;molecular hydrogen
CID 155692558

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-(3-methoxy-2-methylpropyl)-6-methylaniline?
The IUPAC name of 2-ethyl-N-(3-methoxy-2-methylpropyl)-6-methylaniline (CID 116501156) is 2-ethyl-N-(3-methoxy-2-methylpropyl)-6-methylaniline.
What is the SMILES notation for 2-ethyl-N-(3-methoxy-2-methylpropyl)-6-methylaniline?
The canonical SMILES for 2-ethyl-N-(3-methoxy-2-methylpropyl)-6-methylaniline is CCc1cccc(C)c1NCC(C)COC.
What is the InChIKey of 2-ethyl-N-(3-methoxy-2-methylpropyl)-6-methylaniline?
The InChIKey is CABVEFWTPTWUJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO/c1-5-13-8-6-7-12(3)14(13)15-9-11(2)10-16-4/h6-8,11,15H,5,9-10H2,1-4H3.
What are the key properties of 2-ethyl-N-(3-methoxy-2-methylpropyl)-6-methylaniline?
2-ethyl-N-(3-methoxy-2-methylpropyl)-6-methylaniline has a molecular weight of 221.34 g/mol, XLogP of 3.25, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-(3-methoxy-2-methylpropyl)-6-methylaniline is sourced from PubChem (CID 116501156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).