3-methoxy-N-[1-(4-methoxyphenyl)propyl]aniline

C17H21NO2 — CID 43196395

IUPAC3-methoxy-N-[1-(4-methoxyphenyl)propyl]aniline
SMILESCCC(Nc1cccc(OC)c1)c1ccc(OC)cc1
InChIInChI=1S/C17H21NO2/c1-4-17(13-8-10-15(19-2)11-9-13)18-14-6-5-7-16(12-14)20-3/h5-12,17-18H,4H2,1-3H3
InChIKeyRNKXOWUQIZAMBT-UHFFFAOYSA-N
MW271.36 g/mol
LogP4.27
Rot. Bonds6

About 3-methoxy-N-[1-(4-methoxyphenyl)propyl]aniline

3-methoxy-N-[1-(4-methoxyphenyl)propyl]aniline (PubChem CID 43196395) has the molecular formula C17H21NO2 and a molecular weight of 271.36 g/mol. Its IUPAC name is 3-methoxy-N-[1-(4-methoxyphenyl)propyl]aniline.

Molecular Properties

Compound Name3-methoxy-N-[1-(4-methoxyphenyl)propyl]aniline
PubChem CID43196395
Molecular FormulaC17H21NO2
Molecular Weight271.36 g/mol
Exact Mass271.16
IUPAC Name3-methoxy-N-[1-(4-methoxyphenyl)propyl]aniline
SMILESCCC(Nc1cccc(OC)c1)c1ccc(OC)cc1
InChIInChI=1S/C17H21NO2/c1-4-17(13-8-10-15(19-2)11-9-13)18-14-6-5-7-16(12-14)20-3/h5-12,17-18H,4H2,1-3H3
InChIKeyRNKXOWUQIZAMBT-UHFFFAOYSA-N
XLogP4.27
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-methoxy-N-[1-(4-methoxyphenyl)propyl]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

4-methoxy-N-[1-(3-methoxyphenyl)propyl]aniline
CID 46204143
3-methoxy-N-[1-(3-nitrophenyl)propyl]aniline
CID 43133301
N-[1-(3-bromophenyl)propyl]-4-methoxyaniline
CID 43766009
3,4,5-trifluoro-N-[1-(4-methoxyphenyl)propyl]aniline
CID 62809328
3-methoxy-N-[(2S,3S)-3-methylpentan-2-yl]aniline
CID 28548125
4-chloro-3-fluoro-N-[1-(4-methoxyphenyl)propyl]aniline
CID 43721457
2,6-difluoro-N-[1-(4-methoxyphenyl)propyl]aniline
CID 43123944
N-(1-phenylpropyl)-3-propoxyaniline
CID 43693763
4-[1-(3-propoxyanilino)propyl]phenol
CID 43693694
N-hexan-3-yl-3-methoxyaniline
CID 115916725
3-methoxy-N-[(3S)-2-methylpentan-3-yl]aniline
CID 93283290
3-(3-methoxyanilino)-3-phenylpropanenitrile
CID 62779366

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-[1-(4-methoxyphenyl)propyl]aniline?
The IUPAC name of 3-methoxy-N-[1-(4-methoxyphenyl)propyl]aniline (CID 43196395) is 3-methoxy-N-[1-(4-methoxyphenyl)propyl]aniline.
What is the SMILES notation for 3-methoxy-N-[1-(4-methoxyphenyl)propyl]aniline?
The canonical SMILES for 3-methoxy-N-[1-(4-methoxyphenyl)propyl]aniline is CCC(Nc1cccc(OC)c1)c1ccc(OC)cc1.
What is the InChIKey of 3-methoxy-N-[1-(4-methoxyphenyl)propyl]aniline?
The InChIKey is RNKXOWUQIZAMBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO2/c1-4-17(13-8-10-15(19-2)11-9-13)18-14-6-5-7-16(12-14)20-3/h5-12,17-18H,4H2,1-3H3.
What are the key properties of 3-methoxy-N-[1-(4-methoxyphenyl)propyl]aniline?
3-methoxy-N-[1-(4-methoxyphenyl)propyl]aniline has a molecular weight of 271.36 g/mol, XLogP of 4.27, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-[1-(4-methoxyphenyl)propyl]aniline is sourced from PubChem (CID 43196395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).