2-amino-3-(dimethylamino)-3-(2-methoxy-3,4,6-trimethylphenyl)propan-1-ol

C15H26N2O2 — CID 116911647

IUPAC2-amino-3-(dimethylamino)-3-(2-methoxy-3,4,6-trimethylphenyl)propan-1-ol
SMILESCOc1c(C)c(C)cc(C)c1C(C(N)CO)N(C)C
InChIInChI=1S/C15H26N2O2/c1-9-7-10(2)13(15(19-6)11(9)3)14(17(4)5)12(16)8-18/h7,12,14,18H,8,16H2,1-6H3
InChIKeyKSCGGWURWFRRSI-UHFFFAOYSA-N
MW266.38 g/mol
LogP1.54
Rot. Bonds5

About 2-amino-3-(dimethylamino)-3-(2-methoxy-3,4,6-trimethylphenyl)propan-1-ol

2-amino-3-(dimethylamino)-3-(2-methoxy-3,4,6-trimethylphenyl)propan-1-ol (PubChem CID 116911647) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is 2-amino-3-(dimethylamino)-3-(2-methoxy-3,4,6-trimethylphenyl)propan-1-ol.

Molecular Properties

Compound Name2-amino-3-(dimethylamino)-3-(2-methoxy-3,4,6-trimethylphenyl)propan-1-ol
PubChem CID116911647
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC Name2-amino-3-(dimethylamino)-3-(2-methoxy-3,4,6-trimethylphenyl)propan-1-ol
SMILESCOc1c(C)c(C)cc(C)c1C(C(N)CO)N(C)C
InChIInChI=1S/C15H26N2O2/c1-9-7-10(2)13(15(19-6)11(9)3)14(17(4)5)12(16)8-18/h7,12,14,18H,8,16H2,1-6H3
InChIKeyKSCGGWURWFRRSI-UHFFFAOYSA-N
XLogP1.54
TPSA58.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-amino-3-(dimethylamino)-3-(2-methoxy-3,4,6-trimethylphenyl)propan-1-ol 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

2-amino-3-(dimethylamino)-3-(2-methoxy-4,6-dimethylphenyl)propan-1-ol
CID 116911605
1-(2-methoxy-3,4,6-trimethylphenyl)ethanamine
CID 116947379
1-(2-methoxy-3,4,6-trimethylphenyl)-N,N-dimethylpropane-1,3-diamine
CID 116904598
1-(2-methoxy-3,4,6-trimethylphenyl)-1-N,1-N,2-trimethylpropane-1,2-diamine
CID 116904584
2-chloro-1-(2-methoxy-3,4,6-trimethylphenyl)ethanol
CID 116863607
1-(2-methoxy-3,4,6-trimethylphenyl)-N'-methylethane-1,2-diamine
CID 116932540
1-(2-methoxy-3,4,6-trimethylphenyl)butane-1,4-diol
CID 116861375
3-(dimethylamino)-3-(4-methoxy-2,3,6-trimethylphenyl)-2-methylpropan-1-ol
CID 83939317
2-amino-1-(2-methoxy-3,4,6-trimethylphenyl)ethanethiol
CID 116868705
3-methoxy-2-(2-methoxy-3,4,6-trimethylphenyl)propan-1-amine
CID 116835676
2,3-diamino-3-(2-methoxy-3,4,6-trimethylphenyl)propanoic acid
CID 116942305
4-(dimethylamino)-4-(2-methoxy-3,4,6-trimethylphenyl)butanenitrile
CID 116910149

Frequently Asked Questions

What is the IUPAC name of 2-amino-3-(dimethylamino)-3-(2-methoxy-3,4,6-trimethylphenyl)propan-1-ol?
The IUPAC name of 2-amino-3-(dimethylamino)-3-(2-methoxy-3,4,6-trimethylphenyl)propan-1-ol (CID 116911647) is 2-amino-3-(dimethylamino)-3-(2-methoxy-3,4,6-trimethylphenyl)propan-1-ol.
What is the SMILES notation for 2-amino-3-(dimethylamino)-3-(2-methoxy-3,4,6-trimethylphenyl)propan-1-ol?
The canonical SMILES for 2-amino-3-(dimethylamino)-3-(2-methoxy-3,4,6-trimethylphenyl)propan-1-ol is COc1c(C)c(C)cc(C)c1C(C(N)CO)N(C)C.
What is the InChIKey of 2-amino-3-(dimethylamino)-3-(2-methoxy-3,4,6-trimethylphenyl)propan-1-ol?
The InChIKey is KSCGGWURWFRRSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-9-7-10(2)13(15(19-6)11(9)3)14(17(4)5)12(16)8-18/h7,12,14,18H,8,16H2,1-6H3.
What are the key properties of 2-amino-3-(dimethylamino)-3-(2-methoxy-3,4,6-trimethylphenyl)propan-1-ol?
2-amino-3-(dimethylamino)-3-(2-methoxy-3,4,6-trimethylphenyl)propan-1-ol has a molecular weight of 266.38 g/mol, XLogP of 1.54, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-(dimethylamino)-3-(2-methoxy-3,4,6-trimethylphenyl)propan-1-ol is sourced from PubChem (CID 116911647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).