1-(4,5-dimethoxy-2-methylphenyl)-N,2,2-trimethylpropan-1-amine

C15H25NO2 — CID 43626719

IUPAC1-(4,5-dimethoxy-2-methylphenyl)-N,2,2-trimethylpropan-1-amine
SMILESCNC(c1cc(OC)c(OC)cc1C)C(C)(C)C
InChIInChI=1S/C15H25NO2/c1-10-8-12(17-6)13(18-7)9-11(10)14(16-5)15(2,3)4/h8-9,14,16H,1-7H3
InChIKeyMEBZDQCDCCTOIZ-UHFFFAOYSA-N
MW251.37 g/mol
LogP3.32
Rot. Bonds4

About 1-(4,5-dimethoxy-2-methylphenyl)-N,2,2-trimethylpropan-1-amine

1-(4,5-dimethoxy-2-methylphenyl)-N,2,2-trimethylpropan-1-amine (PubChem CID 43626719) has the molecular formula C15H25NO2 and a molecular weight of 251.37 g/mol. Its IUPAC name is 1-(4,5-dimethoxy-2-methylphenyl)-N,2,2-trimethylpropan-1-amine.

Molecular Properties

Compound Name1-(4,5-dimethoxy-2-methylphenyl)-N,2,2-trimethylpropan-1-amine
PubChem CID43626719
Molecular FormulaC15H25NO2
Molecular Weight251.37 g/mol
Exact Mass251.19
IUPAC Name1-(4,5-dimethoxy-2-methylphenyl)-N,2,2-trimethylpropan-1-amine
SMILESCNC(c1cc(OC)c(OC)cc1C)C(C)(C)C
InChIInChI=1S/C15H25NO2/c1-10-8-12(17-6)13(18-7)9-11(10)14(16-5)15(2,3)4/h8-9,14,16H,1-7H3
InChIKeyMEBZDQCDCCTOIZ-UHFFFAOYSA-N
XLogP3.32
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4,5-dimethoxy-2-methylphenyl)-N,2,2-trimethylbutan-1-amine
CID 62678421
1-(4,5-dimethoxy-2-methylphenyl)-N,2,2-trimethylpropane-1,3-diamine
CID 116949042
1-(4,5-dimethoxy-2-methylphenyl)-2,2,3,3,3-pentafluoro-N-methylpropan-1-amine
CID 43626707
1-(2-fluoro-4,5-dimethoxyphenyl)-N,2,2-trimethylpropan-1-amine
CID 62867797
1-(4-methoxy-2,5-dimethylphenyl)-1-N,2-N,2-trimethylpropane-1,2-diamine
CID 116954031
1-bromo-1-(4,5-dimethoxy-2-methylphenyl)-N-methylmethanamine
CID 116961940
1-(2,5-dimethylphenyl)-N,2,2-trimethylpropan-1-amine
CID 43483759
3-(2-methoxy-4,5-dimethylphenyl)-2,2-dimethyl-3-(methylamino)propanoic acid
CID 116953214
1-(5-tert-butyl-4-methoxy-2-methylphenyl)-N-methylethanamine
CID 82496678
1-(4,5-dimethoxy-2-methylphenyl)-N,N'-dimethylpropane-1,3-diamine
CID 116948581
1-(4,5-dimethoxy-2-methylphenyl)-N-methyl-1-(2-methylphenyl)methanamine
CID 43626718
1-(4,5-dimethoxy-2-methylphenyl)-N,4-dimethylpentan-1-amine
CID 43626705

Frequently Asked Questions

What is the IUPAC name of 1-(4,5-dimethoxy-2-methylphenyl)-N,2,2-trimethylpropan-1-amine?
The IUPAC name of 1-(4,5-dimethoxy-2-methylphenyl)-N,2,2-trimethylpropan-1-amine (CID 43626719) is 1-(4,5-dimethoxy-2-methylphenyl)-N,2,2-trimethylpropan-1-amine.
What is the SMILES notation for 1-(4,5-dimethoxy-2-methylphenyl)-N,2,2-trimethylpropan-1-amine?
The canonical SMILES for 1-(4,5-dimethoxy-2-methylphenyl)-N,2,2-trimethylpropan-1-amine is CNC(c1cc(OC)c(OC)cc1C)C(C)(C)C.
What is the InChIKey of 1-(4,5-dimethoxy-2-methylphenyl)-N,2,2-trimethylpropan-1-amine?
The InChIKey is MEBZDQCDCCTOIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO2/c1-10-8-12(17-6)13(18-7)9-11(10)14(16-5)15(2,3)4/h8-9,14,16H,1-7H3.
What are the key properties of 1-(4,5-dimethoxy-2-methylphenyl)-N,2,2-trimethylpropan-1-amine?
1-(4,5-dimethoxy-2-methylphenyl)-N,2,2-trimethylpropan-1-amine has a molecular weight of 251.37 g/mol, XLogP of 3.32, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,5-dimethoxy-2-methylphenyl)-N,2,2-trimethylpropan-1-amine is sourced from PubChem (CID 43626719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).