4-methoxy-N-(4-methoxyphenyl)-N-(1-phenoxypropan-2-yl)aniline

C23H25NO3 — CID 139670197

IUPAC4-methoxy-N-(4-methoxyphenyl)-N-(1-phenoxypropan-2-yl)aniline
SMILESCOc1ccc(N(c2ccc(OC)cc2)C(C)COc2ccccc2)cc1
InChIInChI=1S/C23H25NO3/c1-18(17-27-23-7-5-4-6-8-23)24(19-9-13-21(25-2)14-10-19)20-11-15-22(26-3)16-12-20/h4-16,18H,17H2,1-3H3
InChIKeyDAURXYMCEGRXGW-UHFFFAOYSA-N
MW363.46 g/mol
LogP5.31
Rot. Bonds8

About 4-methoxy-N-(4-methoxyphenyl)-N-(1-phenoxypropan-2-yl)aniline

4-methoxy-N-(4-methoxyphenyl)-N-(1-phenoxypropan-2-yl)aniline (PubChem CID 139670197) has the molecular formula C23H25NO3 and a molecular weight of 363.46 g/mol. Its IUPAC name is 4-methoxy-N-(4-methoxyphenyl)-N-(1-phenoxypropan-2-yl)aniline.

Molecular Properties

Compound Name4-methoxy-N-(4-methoxyphenyl)-N-(1-phenoxypropan-2-yl)aniline
PubChem CID139670197
Molecular FormulaC23H25NO3
Molecular Weight363.46 g/mol
Exact Mass363.18
IUPAC Name4-methoxy-N-(4-methoxyphenyl)-N-(1-phenoxypropan-2-yl)aniline
SMILESCOc1ccc(N(c2ccc(OC)cc2)C(C)COc2ccccc2)cc1
InChIInChI=1S/C23H25NO3/c1-18(17-27-23-7-5-4-6-8-23)24(19-9-13-21(25-2)14-10-19)20-11-15-22(26-3)16-12-20/h4-16,18H,17H2,1-3H3
InChIKeyDAURXYMCEGRXGW-UHFFFAOYSA-N
XLogP5.31
TPSA30.93 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500363.46
LogP ≤ 55.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-ethoxyphenyl)-4-methoxy-N-(4-phenoxyphenyl)aniline
CID 54107387
4-methoxy-N-[4-[3-[4-(N-(4-methoxyphenyl)anilino)phenoxy]propoxy]phenyl]-N-phenylaniline
CID 18996741
4-N-(4-butan-2-ylphenyl)-4-N-(4-methoxyphenyl)-1-N,1-N-diphenylbenzene-1,4-diamine
CID 122451360
1-N,4-N-bis[4-(4-methoxy-N-(4-methoxyphenyl)anilino)phenyl]-1-N,4-N-diphenylbenzene-1,4-diamine
CID 132507926
N-(4-butoxyphenyl)-4-methoxy-N-phenylaniline
CID 18996772
[1-(4-methoxyphenyl)-2-phenoxyethyl]hydrazine
CID 105213017
anisole;(4-bromo-2-methylbutoxy)benzene
CID 174371067
4-[4-(2-methylpropoxy)phenoxy]-N,N-diphenylaniline
CID 58701260
1-(4-methoxyphenyl)sulfanyl-3-phenoxypropane-2-thiol
CID 102274007
anisole;argon;propane
CID 165043377
(2S)-1-(4-methoxyphenoxy)propan-2-amine
CID 7263362
4-[tert-butyl(dimethyl)silyl]oxy-N-[1-[tert-butyl(dimethyl)silyl]oxypropan-2-yl]-N-phenylaniline
CID 163216748

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-(4-methoxyphenyl)-N-(1-phenoxypropan-2-yl)aniline?
The IUPAC name of 4-methoxy-N-(4-methoxyphenyl)-N-(1-phenoxypropan-2-yl)aniline (CID 139670197) is 4-methoxy-N-(4-methoxyphenyl)-N-(1-phenoxypropan-2-yl)aniline.
What is the SMILES notation for 4-methoxy-N-(4-methoxyphenyl)-N-(1-phenoxypropan-2-yl)aniline?
The canonical SMILES for 4-methoxy-N-(4-methoxyphenyl)-N-(1-phenoxypropan-2-yl)aniline is COc1ccc(N(c2ccc(OC)cc2)C(C)COc2ccccc2)cc1.
What is the InChIKey of 4-methoxy-N-(4-methoxyphenyl)-N-(1-phenoxypropan-2-yl)aniline?
The InChIKey is DAURXYMCEGRXGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25NO3/c1-18(17-27-23-7-5-4-6-8-23)24(19-9-13-21(25-2)14-10-19)20-11-15-22(26-3)16-12-20/h4-16,18H,17H2,1-3H3.
What are the key properties of 4-methoxy-N-(4-methoxyphenyl)-N-(1-phenoxypropan-2-yl)aniline?
4-methoxy-N-(4-methoxyphenyl)-N-(1-phenoxypropan-2-yl)aniline has a molecular weight of 363.46 g/mol, XLogP of 5.31, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-(4-methoxyphenyl)-N-(1-phenoxypropan-2-yl)aniline is sourced from PubChem (CID 139670197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).