1-N,2-N,2-N-triethyl-1-(4-methoxy-2-methylphenyl)-2-methylpropane-1,2-diamine

C18H32N2O — CID 79046675

IUPAC1-N,2-N,2-N-triethyl-1-(4-methoxy-2-methylphenyl)-2-methylpropane-1,2-diamine
SMILESCCNC(c1ccc(OC)cc1C)C(C)(C)N(CC)CC
InChIInChI=1S/C18H32N2O/c1-8-19-17(18(5,6)20(9-2)10-3)16-12-11-15(21-7)13-14(16)4/h11-13,17,19H,8-10H2,1-7H3
InChIKeyVYMTWAWKHRSPPI-UHFFFAOYSA-N
MW292.47 g/mol
LogP3.77
Rot. Bonds8

About 1-N,2-N,2-N-triethyl-1-(4-methoxy-2-methylphenyl)-2-methylpropane-1,2-diamine

1-N,2-N,2-N-triethyl-1-(4-methoxy-2-methylphenyl)-2-methylpropane-1,2-diamine (PubChem CID 79046675) has the molecular formula C18H32N2O and a molecular weight of 292.47 g/mol. Its IUPAC name is 1-N,2-N,2-N-triethyl-1-(4-methoxy-2-methylphenyl)-2-methylpropane-1,2-diamine.

Molecular Properties

Compound Name1-N,2-N,2-N-triethyl-1-(4-methoxy-2-methylphenyl)-2-methylpropane-1,2-diamine
PubChem CID79046675
Molecular FormulaC18H32N2O
Molecular Weight292.47 g/mol
Exact Mass292.25
IUPAC Name1-N,2-N,2-N-triethyl-1-(4-methoxy-2-methylphenyl)-2-methylpropane-1,2-diamine
SMILESCCNC(c1ccc(OC)cc1C)C(C)(C)N(CC)CC
InChIInChI=1S/C18H32N2O/c1-8-19-17(18(5,6)20(9-2)10-3)16-12-11-15(21-7)13-14(16)4/h11-13,17,19H,8-10H2,1-7H3
InChIKeyVYMTWAWKHRSPPI-UHFFFAOYSA-N
XLogP3.77
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.47
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-N,2-N,2-N-triethyl-1-(4-methoxy-2-methylphenyl)-2-methylpropane-1,2-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-N,2-N,2-N-triethyl-1-(4-fluoro-2-methylphenyl)-2-methylpropane-1,2-diamine
CID 79056921
N-ethyl-2-methoxy-1-(4-methoxy-2-methylphenyl)-2-methylbutan-1-amine
CID 116758102
1-(2,4-dimethoxyphenyl)-2-N,2-N-diethyl-1-N,2-dimethylpropane-1,2-diamine
CID 79046908
1-(4-methoxy-2-methylphenyl)-2,2-dimethyl-N-propylbutan-1-amine
CID 63503187
1-(2,5-dimethoxyphenyl)-N,N-diethyl-1-hydrazinyl-2-methylpropan-2-amine
CID 105239363
N-ethyl-1-(4-methoxy-2-methylphenyl)-2-methylbutan-1-amine
CID 43490085
1-N-ethyl-1-(4-fluoro-2-methylphenyl)-2-N,2-N,2-trimethylpropane-1,2-diamine
CID 79053416
2-methoxy-1-(4-methoxy-2-methylphenyl)-2-methylbutan-1-amine
CID 116757522
1-N-ethyl-1-(2-fluoro-4-methoxyphenyl)-2-N,2-N,2-trimethylbutane-1,2-diamine
CID 103395656
N-ethyl-1-(4-methoxy-2-methylphenyl)-2-propoxyethanamine
CID 65313666
N-ethyl-1-(4-methoxy-2-methylphenyl)-2-methylsulfonylpropan-1-amine
CID 104518588
2-cyclopropyl-N-ethyl-1-(4-methoxy-2-methylphenyl)propan-1-amine
CID 83153801

Frequently Asked Questions

What is the IUPAC name of 1-N,2-N,2-N-triethyl-1-(4-methoxy-2-methylphenyl)-2-methylpropane-1,2-diamine?
The IUPAC name of 1-N,2-N,2-N-triethyl-1-(4-methoxy-2-methylphenyl)-2-methylpropane-1,2-diamine (CID 79046675) is 1-N,2-N,2-N-triethyl-1-(4-methoxy-2-methylphenyl)-2-methylpropane-1,2-diamine.
What is the SMILES notation for 1-N,2-N,2-N-triethyl-1-(4-methoxy-2-methylphenyl)-2-methylpropane-1,2-diamine?
The canonical SMILES for 1-N,2-N,2-N-triethyl-1-(4-methoxy-2-methylphenyl)-2-methylpropane-1,2-diamine is CCNC(c1ccc(OC)cc1C)C(C)(C)N(CC)CC.
What is the InChIKey of 1-N,2-N,2-N-triethyl-1-(4-methoxy-2-methylphenyl)-2-methylpropane-1,2-diamine?
The InChIKey is VYMTWAWKHRSPPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H32N2O/c1-8-19-17(18(5,6)20(9-2)10-3)16-12-11-15(21-7)13-14(16)4/h11-13,17,19H,8-10H2,1-7H3.
What are the key properties of 1-N,2-N,2-N-triethyl-1-(4-methoxy-2-methylphenyl)-2-methylpropane-1,2-diamine?
1-N,2-N,2-N-triethyl-1-(4-methoxy-2-methylphenyl)-2-methylpropane-1,2-diamine has a molecular weight of 292.47 g/mol, XLogP of 3.77, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,2-N,2-N-triethyl-1-(4-methoxy-2-methylphenyl)-2-methylpropane-1,2-diamine is sourced from PubChem (CID 79046675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).