1-(3,5-dimethylphenyl)-N-[2-(2-methoxyphenyl)ethyl]ethanamine

C19H25NO — CID 106259657

IUPAC1-(3,5-dimethylphenyl)-N-[2-(2-methoxyphenyl)ethyl]ethanamine
SMILESCOc1ccccc1CCNC(C)c1cc(C)cc(C)c1
InChIInChI=1S/C19H25NO/c1-14-11-15(2)13-18(12-14)16(3)20-10-9-17-7-5-6-8-19(17)21-4/h5-8,11-13,16,20H,9-10H2,1-4H3
InChIKeyRWOCJURGFPSNIQ-UHFFFAOYSA-N
MW283.42 g/mol
LogP4.21
Rot. Bonds6

About 1-(3,5-dimethylphenyl)-N-[2-(2-methoxyphenyl)ethyl]ethanamine

1-(3,5-dimethylphenyl)-N-[2-(2-methoxyphenyl)ethyl]ethanamine (PubChem CID 106259657) has the molecular formula C19H25NO and a molecular weight of 283.42 g/mol. Its IUPAC name is 1-(3,5-dimethylphenyl)-N-[2-(2-methoxyphenyl)ethyl]ethanamine.

Molecular Properties

Compound Name1-(3,5-dimethylphenyl)-N-[2-(2-methoxyphenyl)ethyl]ethanamine
PubChem CID106259657
Molecular FormulaC19H25NO
Molecular Weight283.42 g/mol
Exact Mass283.19
IUPAC Name1-(3,5-dimethylphenyl)-N-[2-(2-methoxyphenyl)ethyl]ethanamine
SMILESCOc1ccccc1CCNC(C)c1cc(C)cc(C)c1
InChIInChI=1S/C19H25NO/c1-14-11-15(2)13-18(12-14)16(3)20-10-9-17-7-5-6-8-19(17)21-4/h5-8,11-13,16,20H,9-10H2,1-4H3
InChIKeyRWOCJURGFPSNIQ-UHFFFAOYSA-N
XLogP4.21
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3,5-dimethylphenyl)-N-[(2-methoxyphenyl)methyl]ethanamine
CID 78950239
1-(furan-3-yl)-N-[2-(2-methoxyphenyl)ethyl]ethanamine
CID 113259789
1-(2,5-dichlorophenyl)-N-[2-(2-methoxyphenyl)ethyl]ethanamine
CID 106259982
1,1-dimethoxy-N-[2-(2-methoxyphenyl)ethyl]propan-2-amine
CID 106259984
N-[2-(2-methoxyphenyl)ethyl]-1-(2-methylphenyl)propan-2-amine
CID 57276686
1-(2-bromo-4-fluorophenyl)-N-[2-(2-methoxyphenyl)ethyl]ethanamine
CID 106259760
1-(2,5-dichlorothiophen-3-yl)-N-[2-(2-methoxyphenyl)ethyl]ethanamine
CID 106259694
N-[2-(2-methoxyphenyl)ethyl]-1-(1,3-thiazol-5-yl)ethanamine
CID 103775879
1-(2-methoxy-5-methylphenyl)-N-[2-(2-methylphenyl)ethyl]ethanamine
CID 79756686
3-fluoro-4-[1-[2-(2-methoxyphenyl)ethylamino]ethyl]phenol
CID 106259746
2-N-[2-(2-methoxyphenyl)ethyl]-3-methylbutane-1,2-diamine
CID 106345493
N-[2-(2-fluorophenyl)ethyl]-1-(4-methylphenyl)ethanamine
CID 43095856

Frequently Asked Questions

What is the IUPAC name of 1-(3,5-dimethylphenyl)-N-[2-(2-methoxyphenyl)ethyl]ethanamine?
The IUPAC name of 1-(3,5-dimethylphenyl)-N-[2-(2-methoxyphenyl)ethyl]ethanamine (CID 106259657) is 1-(3,5-dimethylphenyl)-N-[2-(2-methoxyphenyl)ethyl]ethanamine.
What is the SMILES notation for 1-(3,5-dimethylphenyl)-N-[2-(2-methoxyphenyl)ethyl]ethanamine?
The canonical SMILES for 1-(3,5-dimethylphenyl)-N-[2-(2-methoxyphenyl)ethyl]ethanamine is COc1ccccc1CCNC(C)c1cc(C)cc(C)c1.
What is the InChIKey of 1-(3,5-dimethylphenyl)-N-[2-(2-methoxyphenyl)ethyl]ethanamine?
The InChIKey is RWOCJURGFPSNIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO/c1-14-11-15(2)13-18(12-14)16(3)20-10-9-17-7-5-6-8-19(17)21-4/h5-8,11-13,16,20H,9-10H2,1-4H3.
What are the key properties of 1-(3,5-dimethylphenyl)-N-[2-(2-methoxyphenyl)ethyl]ethanamine?
1-(3,5-dimethylphenyl)-N-[2-(2-methoxyphenyl)ethyl]ethanamine has a molecular weight of 283.42 g/mol, XLogP of 4.21, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,5-dimethylphenyl)-N-[2-(2-methoxyphenyl)ethyl]ethanamine is sourced from PubChem (CID 106259657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).