1-(2-ethoxy-5-methylphenyl)-N-methyl-1-(2-methylphenyl)methanamine

C18H23NO — CID 62302995

IUPAC1-(2-ethoxy-5-methylphenyl)-N-methyl-1-(2-methylphenyl)methanamine
SMILESCCOc1ccc(C)cc1C(NC)c1ccccc1C
InChIInChI=1S/C18H23NO/c1-5-20-17-11-10-13(2)12-16(17)18(19-4)15-9-7-6-8-14(15)3/h6-12,18-19H,5H2,1-4H3
InChIKeyVDZPDILWTLRARS-UHFFFAOYSA-N
MW269.39 g/mol
LogP4.01
Rot. Bonds5

About 1-(2-ethoxy-5-methylphenyl)-N-methyl-1-(2-methylphenyl)methanamine

1-(2-ethoxy-5-methylphenyl)-N-methyl-1-(2-methylphenyl)methanamine (PubChem CID 62302995) has the molecular formula C18H23NO and a molecular weight of 269.39 g/mol. Its IUPAC name is 1-(2-ethoxy-5-methylphenyl)-N-methyl-1-(2-methylphenyl)methanamine.

Molecular Properties

Compound Name1-(2-ethoxy-5-methylphenyl)-N-methyl-1-(2-methylphenyl)methanamine
PubChem CID62302995
Molecular FormulaC18H23NO
Molecular Weight269.39 g/mol
Exact Mass269.18
IUPAC Name1-(2-ethoxy-5-methylphenyl)-N-methyl-1-(2-methylphenyl)methanamine
SMILESCCOc1ccc(C)cc1C(NC)c1ccccc1C
InChIInChI=1S/C18H23NO/c1-5-20-17-11-10-13(2)12-16(17)18(19-4)15-9-7-6-8-14(15)3/h6-12,18-19H,5H2,1-4H3
InChIKeyVDZPDILWTLRARS-UHFFFAOYSA-N
XLogP4.01
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 ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,3-dimethylphenyl)-1-(2-ethoxy-5-methylphenyl)-N-methylmethanamine
CID 62301816
1-(5-bromo-2-ethoxyphenyl)-1-(2,4-dimethylphenyl)-N-methylmethanamine
CID 43487365
1-(2,5-dimethylphenyl)-N-methyl-1-(2-propoxyphenyl)methanamine
CID 105035882
(2-ethoxy-5-methylphenyl)-(2-methylphenyl)methanol
CID 62302666
1-(2-ethoxy-5-methylphenyl)-N-methyl-2-(2-methylphenyl)ethanamine
CID 62302998
1-(2-methoxy-4-methylphenyl)-N-methyl-1-(2-methylphenyl)methanamine
CID 106792109
1-(5-chloro-2-methylphenyl)-1-(2-ethoxyphenyl)-N-methylmethanamine
CID 115853667
N-[(5-bromo-2-ethoxyphenyl)-(2-methylphenyl)methyl]ethanamine
CID 43493559
1-(2-bromo-3-methylphenyl)-1-(2-methoxy-5-methylphenyl)-N-methylmethanamine
CID 107981976
1-(2-ethoxy-5-methylphenyl)-1-(5-ethylthiophen-2-yl)-N-methylmethanamine
CID 62302159
1-(5-bromo-2-ethoxyphenyl)-1-(2-methoxyphenyl)-N-methylmethanamine
CID 43487355
1-(3-chlorothiophen-2-yl)-1-(2-ethoxy-5-methylphenyl)-N-methylmethanamine
CID 80645153

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethoxy-5-methylphenyl)-N-methyl-1-(2-methylphenyl)methanamine?
The IUPAC name of 1-(2-ethoxy-5-methylphenyl)-N-methyl-1-(2-methylphenyl)methanamine (CID 62302995) is 1-(2-ethoxy-5-methylphenyl)-N-methyl-1-(2-methylphenyl)methanamine.
What is the SMILES notation for 1-(2-ethoxy-5-methylphenyl)-N-methyl-1-(2-methylphenyl)methanamine?
The canonical SMILES for 1-(2-ethoxy-5-methylphenyl)-N-methyl-1-(2-methylphenyl)methanamine is CCOc1ccc(C)cc1C(NC)c1ccccc1C.
What is the InChIKey of 1-(2-ethoxy-5-methylphenyl)-N-methyl-1-(2-methylphenyl)methanamine?
The InChIKey is VDZPDILWTLRARS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NO/c1-5-20-17-11-10-13(2)12-16(17)18(19-4)15-9-7-6-8-14(15)3/h6-12,18-19H,5H2,1-4H3.
What are the key properties of 1-(2-ethoxy-5-methylphenyl)-N-methyl-1-(2-methylphenyl)methanamine?
1-(2-ethoxy-5-methylphenyl)-N-methyl-1-(2-methylphenyl)methanamine has a molecular weight of 269.39 g/mol, XLogP of 4.01, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethoxy-5-methylphenyl)-N-methyl-1-(2-methylphenyl)methanamine is sourced from PubChem (CID 62302995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).