2-methoxy-4-methyl-N-(2-methyl-1-phenylpropyl)aniline

C18H23NO — CID 60930849

IUPAC2-methoxy-4-methyl-N-(2-methyl-1-phenylpropyl)aniline
SMILESCOc1cc(C)ccc1NC(c1ccccc1)C(C)C
InChIInChI=1S/C18H23NO/c1-13(2)18(15-8-6-5-7-9-15)19-16-11-10-14(3)12-17(16)20-4/h5-13,18-19H,1-4H3
InChIKeyUNQVNJFFCAVRCI-UHFFFAOYSA-N
MW269.39 g/mol
LogP4.81
Rot. Bonds5

About 2-methoxy-4-methyl-N-(2-methyl-1-phenylpropyl)aniline

2-methoxy-4-methyl-N-(2-methyl-1-phenylpropyl)aniline (PubChem CID 60930849) has the molecular formula C18H23NO and a molecular weight of 269.39 g/mol. Its IUPAC name is 2-methoxy-4-methyl-N-(2-methyl-1-phenylpropyl)aniline.

Molecular Properties

Compound Name2-methoxy-4-methyl-N-(2-methyl-1-phenylpropyl)aniline
PubChem CID60930849
Molecular FormulaC18H23NO
Molecular Weight269.39 g/mol
Exact Mass269.18
IUPAC Name2-methoxy-4-methyl-N-(2-methyl-1-phenylpropyl)aniline
SMILESCOc1cc(C)ccc1NC(c1ccccc1)C(C)C
InChIInChI=1S/C18H23NO/c1-13(2)18(15-8-6-5-7-9-15)19-16-11-10-14(3)12-17(16)20-4/h5-13,18-19H,1-4H3
InChIKeyUNQVNJFFCAVRCI-UHFFFAOYSA-N
XLogP4.81
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 54.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,4-dimethyl-N-(2-methyl-1-phenylpropyl)aniline
CID 43755773
2-methoxy-4-methyl-N-propan-2-ylaniline
CID 59391426
4-bromo-2-methoxy-6-methyl-N-(2-methyl-1-phenylpropyl)aniline
CID 63450033
N-(2,6-dimethylheptan-4-yl)-2-methoxy-4-methylaniline
CID 63451142
2,4-dimethoxy-N-(1-phenylethyl)aniline
CID 11586940
N-[1-(1,3-benzothiazol-2-yl)ethyl]-2-methoxy-4-methylaniline
CID 60930843
2-methoxy-N-[1-(2-methoxy-4-methylphenyl)ethyl]aniline
CID 43757835
N-[1-(4-fluoro-3-methoxyphenyl)ethyl]-2-methoxy-4-methylaniline
CID 83058583
2-methoxy-5-methyl-N-(2-methyl-1-thiophen-2-ylpropyl)aniline
CID 43761105
N-(2-methoxy-4-methylphenyl)-2-phenylbutanamide
CID 3495763
N-benzyl-2-methoxy-4-methylaniline
CID 54865649
(1R,2R)-2-(2-methoxyanilino)-1,2-diphenylethanol
CID 11174608

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-4-methyl-N-(2-methyl-1-phenylpropyl)aniline?
The IUPAC name of 2-methoxy-4-methyl-N-(2-methyl-1-phenylpropyl)aniline (CID 60930849) is 2-methoxy-4-methyl-N-(2-methyl-1-phenylpropyl)aniline.
What is the SMILES notation for 2-methoxy-4-methyl-N-(2-methyl-1-phenylpropyl)aniline?
The canonical SMILES for 2-methoxy-4-methyl-N-(2-methyl-1-phenylpropyl)aniline is COc1cc(C)ccc1NC(c1ccccc1)C(C)C.
What is the InChIKey of 2-methoxy-4-methyl-N-(2-methyl-1-phenylpropyl)aniline?
The InChIKey is UNQVNJFFCAVRCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NO/c1-13(2)18(15-8-6-5-7-9-15)19-16-11-10-14(3)12-17(16)20-4/h5-13,18-19H,1-4H3.
What are the key properties of 2-methoxy-4-methyl-N-(2-methyl-1-phenylpropyl)aniline?
2-methoxy-4-methyl-N-(2-methyl-1-phenylpropyl)aniline has a molecular weight of 269.39 g/mol, XLogP of 4.81, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-4-methyl-N-(2-methyl-1-phenylpropyl)aniline is sourced from PubChem (CID 60930849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).