2-methoxy-N-methyl-N-[(4-methylphenyl)methyl]ethanamine

C12H19NO — CID 22951575

IUPAC2-methoxy-N-methyl-N-[(4-methylphenyl)methyl]ethanamine
SMILESCOCCN(C)Cc1ccc(C)cc1
InChIInChI=1S/C12H19NO/c1-11-4-6-12(7-5-11)10-13(2)8-9-14-3/h4-7H,8-10H2,1-3H3
InChIKeyWCPNLLXEOITEPG-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.07
Rot. Bonds5

About 2-methoxy-N-methyl-N-[(4-methylphenyl)methyl]ethanamine

2-methoxy-N-methyl-N-[(4-methylphenyl)methyl]ethanamine (PubChem CID 22951575) has the molecular formula C12H19NO and a molecular weight of 193.29 g/mol. Its IUPAC name is 2-methoxy-N-methyl-N-[(4-methylphenyl)methyl]ethanamine.

Molecular Properties

Compound Name2-methoxy-N-methyl-N-[(4-methylphenyl)methyl]ethanamine
PubChem CID22951575
Molecular FormulaC12H19NO
Molecular Weight193.29 g/mol
Exact Mass193.15
IUPAC Name2-methoxy-N-methyl-N-[(4-methylphenyl)methyl]ethanamine
SMILESCOCCN(C)Cc1ccc(C)cc1
InChIInChI=1S/C12H19NO/c1-11-4-6-12(7-5-11)10-13(2)8-9-14-3/h4-7H,8-10H2,1-3H3
InChIKeyWCPNLLXEOITEPG-UHFFFAOYSA-N
XLogP2.07
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;2-methoxy-N-methyl-N-[(4-methylphenyl)methyl]ethanamine
CID 143902975
2-methoxy-N-[[4-[[2-methoxyethyl(methyl)amino]methyl]phenyl]methyl]-N-methylethanamine
CID 171480765
N'-ethyl-N'-(2-methoxyethyl)-N-methyl-N-[(4-methylphenyl)methyl]ethane-1,2-diamine
CID 168901210
2-(2-chloroethoxy)-N-methyl-N-[(4-methylphenyl)methyl]ethanamine
CID 63666093
methyl 3-[methyl-[(4-methylphenyl)methyl]amino]propanoate
CID 28830279
4-[[2-methoxyethyl(methyl)amino]methyl]benzenecarbothioamide
CID 61427647
2-methoxy-N-methyl-N-[[4-(trifluoromethoxy)phenyl]methyl]ethanamine
CID 70831051
3-methoxy-N-methyl-N-[(4-methylphenyl)methyl]butan-1-amine
CID 123976999
2-[2-methoxyethyl-[(4-methylphenyl)methyl]amino]acetic acid
CID 54968853
N-[[4-[[2-methoxyethyl(methyl)amino]methyl]phenyl]methyl]-2-methylpropan-1-amine
CID 62448969
N-[2-[4-[[2-methoxyethyl(methyl)amino]methyl]phenyl]ethyl]-2-methylpropan-2-amine
CID 105347551
N-[2-[4-[[2-methoxyethyl(methyl)amino]methyl]phenyl]ethyl]propan-1-amine
CID 105347558

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-methyl-N-[(4-methylphenyl)methyl]ethanamine?
The IUPAC name of 2-methoxy-N-methyl-N-[(4-methylphenyl)methyl]ethanamine (CID 22951575) is 2-methoxy-N-methyl-N-[(4-methylphenyl)methyl]ethanamine.
What is the SMILES notation for 2-methoxy-N-methyl-N-[(4-methylphenyl)methyl]ethanamine?
The canonical SMILES for 2-methoxy-N-methyl-N-[(4-methylphenyl)methyl]ethanamine is COCCN(C)Cc1ccc(C)cc1.
What is the InChIKey of 2-methoxy-N-methyl-N-[(4-methylphenyl)methyl]ethanamine?
The InChIKey is WCPNLLXEOITEPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO/c1-11-4-6-12(7-5-11)10-13(2)8-9-14-3/h4-7H,8-10H2,1-3H3.
What are the key properties of 2-methoxy-N-methyl-N-[(4-methylphenyl)methyl]ethanamine?
2-methoxy-N-methyl-N-[(4-methylphenyl)methyl]ethanamine has a molecular weight of 193.29 g/mol, XLogP of 2.07, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-methyl-N-[(4-methylphenyl)methyl]ethanamine is sourced from PubChem (CID 22951575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).