1-(4-methoxy-2-methylphenyl)-N,N-dimethyl-2-phenylethanamine

C18H23NO — CID 24838120

IUPAC1-(4-methoxy-2-methylphenyl)-N,N-dimethyl-2-phenylethanamine
SMILESCOc1ccc(C(Cc2ccccc2)N(C)C)c(C)c1
InChIInChI=1S/C18H23NO/c1-14-12-16(20-4)10-11-17(14)18(19(2)3)13-15-8-6-5-7-9-15/h5-12,18H,13H2,1-4H3
InChIKeySLYKOCYMTXGUJA-UHFFFAOYSA-N
MW269.39 g/mol
LogP3.85
Rot. Bonds5

About 1-(4-methoxy-2-methylphenyl)-N,N-dimethyl-2-phenylethanamine

1-(4-methoxy-2-methylphenyl)-N,N-dimethyl-2-phenylethanamine (PubChem CID 24838120) has the molecular formula C18H23NO and a molecular weight of 269.39 g/mol. Its IUPAC name is 1-(4-methoxy-2-methylphenyl)-N,N-dimethyl-2-phenylethanamine.

Molecular Properties

Compound Name1-(4-methoxy-2-methylphenyl)-N,N-dimethyl-2-phenylethanamine
PubChem CID24838120
Molecular FormulaC18H23NO
Molecular Weight269.39 g/mol
Exact Mass269.18
IUPAC Name1-(4-methoxy-2-methylphenyl)-N,N-dimethyl-2-phenylethanamine
SMILESCOc1ccc(C(Cc2ccccc2)N(C)C)c(C)c1
InChIInChI=1S/C18H23NO/c1-14-12-16(20-4)10-11-17(14)18(19(2)3)13-15-8-6-5-7-9-15/h5-12,18H,13H2,1-4H3
InChIKeySLYKOCYMTXGUJA-UHFFFAOYSA-N
XLogP3.85
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 53.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-methoxyphenyl)-N,N-dimethyl-2-phenylethanamine
CID 24838118
1-(4-methoxy-2-methylphenyl)-N-methyl-2-(4-methylphenyl)ethanamine
CID 43482745
5-methoxy-2-[1-(1-phenylpropan-2-ylamino)ethyl]phenol
CID 63012949
(4-methoxy-2-methylphenyl)-phenylmethanol
CID 61101114
2-chloro-1-(1-chloro-2-phenylethyl)-4-methoxybenzene
CID 63434208
1-(4-methoxy-2-methylphenyl)-N',N'-dimethylethane-1,2-diamine
CID 79093283
1-(4-methoxy-2-methylphenyl)-N-methyl-2-pyridin-3-ylethanamine
CID 65313099
3-(3-hydroxyphenyl)-2-(4-methoxy-2-methylphenyl)propanoic acid
CID 83956081
1-(4-methoxy-2-methylphenyl)-2-(2-methoxyphenyl)-N-methylethanamine
CID 43482757
CID 155667692
CID 155667692
1-(4-methoxy-2-methylphenyl)-2-pyridin-4-ylethanamine
CID 65318126
1-benzyl-4-[2-(4-methoxy-2-methylphenyl)propyl]triazole
CID 112719043

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxy-2-methylphenyl)-N,N-dimethyl-2-phenylethanamine?
The IUPAC name of 1-(4-methoxy-2-methylphenyl)-N,N-dimethyl-2-phenylethanamine (CID 24838120) is 1-(4-methoxy-2-methylphenyl)-N,N-dimethyl-2-phenylethanamine.
What is the SMILES notation for 1-(4-methoxy-2-methylphenyl)-N,N-dimethyl-2-phenylethanamine?
The canonical SMILES for 1-(4-methoxy-2-methylphenyl)-N,N-dimethyl-2-phenylethanamine is COc1ccc(C(Cc2ccccc2)N(C)C)c(C)c1.
What is the InChIKey of 1-(4-methoxy-2-methylphenyl)-N,N-dimethyl-2-phenylethanamine?
The InChIKey is SLYKOCYMTXGUJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NO/c1-14-12-16(20-4)10-11-17(14)18(19(2)3)13-15-8-6-5-7-9-15/h5-12,18H,13H2,1-4H3.
What are the key properties of 1-(4-methoxy-2-methylphenyl)-N,N-dimethyl-2-phenylethanamine?
1-(4-methoxy-2-methylphenyl)-N,N-dimethyl-2-phenylethanamine has a molecular weight of 269.39 g/mol, XLogP of 3.85, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxy-2-methylphenyl)-N,N-dimethyl-2-phenylethanamine is sourced from PubChem (CID 24838120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).