1-(2,6-dimethoxyphenyl)-2-N,2-N,2-trimethylbutane-1,2-diamine

C15H26N2O2 — CID 116810559

IUPAC1-(2,6-dimethoxyphenyl)-2-N,2-N,2-trimethylbutane-1,2-diamine
SMILESCCC(C)(C(N)c1c(OC)cccc1OC)N(C)C
InChIInChI=1S/C15H26N2O2/c1-7-15(2,17(3)4)14(16)13-11(18-5)9-8-10-12(13)19-6/h8-10,14H,7,16H2,1-6H3
InChIKeyFIHLDHDUEFTNEF-UHFFFAOYSA-N
MW266.38 g/mol
LogP2.43
Rot. Bonds6

About 1-(2,6-dimethoxyphenyl)-2-N,2-N,2-trimethylbutane-1,2-diamine

1-(2,6-dimethoxyphenyl)-2-N,2-N,2-trimethylbutane-1,2-diamine (PubChem CID 116810559) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is 1-(2,6-dimethoxyphenyl)-2-N,2-N,2-trimethylbutane-1,2-diamine.

Molecular Properties

Compound Name1-(2,6-dimethoxyphenyl)-2-N,2-N,2-trimethylbutane-1,2-diamine
PubChem CID116810559
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC Name1-(2,6-dimethoxyphenyl)-2-N,2-N,2-trimethylbutane-1,2-diamine
SMILESCCC(C)(C(N)c1c(OC)cccc1OC)N(C)C
InChIInChI=1S/C15H26N2O2/c1-7-15(2,17(3)4)14(16)13-11(18-5)9-8-10-12(13)19-6/h8-10,14H,7,16H2,1-6H3
InChIKeyFIHLDHDUEFTNEF-UHFFFAOYSA-N
XLogP2.43
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(2,6-dimethoxyphenyl)-2-N,2-N,2-trimethylbutane-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-(2,6-difluorophenyl)-2-N,2-N,2-trimethylbutane-1,2-diamine
CID 79063864
1-(3-bromo-2,4-dimethoxyphenyl)-2-N,2-N,2-trimethylbutane-1,2-diamine
CID 103523429
(1R)-1-(2,6-dimethoxyphenyl)propan-1-amine;hydrochloride
CID 171201163
(1S)-1-(2,6-dimethoxyphenyl)ethane-1,2-diamine;hydrochloride
CID 171201155
(1R,2S)-1-amino-1-(2,6-dimethoxyphenyl)-3,3-dimethylbutan-2-ol;hydrochloride
CID 171261410
2-[(1S)-1-aminopropyl]-3-methoxyphenol;hydrochloride
CID 171235918
1-(2,6-dimethoxyphenyl)ethane-1,2-diamine
CID 22756535
(1S)-1-(2,6-dimethoxyphenyl)-3-methylbutan-1-amine;hydrochloride
CID 171220710
ethyl 2-amino-2-(2,6-dimethoxyphenyl)acetate;hydrochloride
CID 121002575
1-(3,4-dimethoxyphenyl)-1-hydrazinyl-N,N,2-trimethylbutan-2-amine
CID 105240484
3-(2-methoxy-N-methylanilino)-3-methylpentan-2-ol
CID 114274916
(3R)-3-amino-3-(2,6-dimethoxyphenyl)propan-1-ol;hydrochloride
CID 171201207

Frequently Asked Questions

What is the IUPAC name of 1-(2,6-dimethoxyphenyl)-2-N,2-N,2-trimethylbutane-1,2-diamine?
The IUPAC name of 1-(2,6-dimethoxyphenyl)-2-N,2-N,2-trimethylbutane-1,2-diamine (CID 116810559) is 1-(2,6-dimethoxyphenyl)-2-N,2-N,2-trimethylbutane-1,2-diamine.
What is the SMILES notation for 1-(2,6-dimethoxyphenyl)-2-N,2-N,2-trimethylbutane-1,2-diamine?
The canonical SMILES for 1-(2,6-dimethoxyphenyl)-2-N,2-N,2-trimethylbutane-1,2-diamine is CCC(C)(C(N)c1c(OC)cccc1OC)N(C)C.
What is the InChIKey of 1-(2,6-dimethoxyphenyl)-2-N,2-N,2-trimethylbutane-1,2-diamine?
The InChIKey is FIHLDHDUEFTNEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-7-15(2,17(3)4)14(16)13-11(18-5)9-8-10-12(13)19-6/h8-10,14H,7,16H2,1-6H3.
What are the key properties of 1-(2,6-dimethoxyphenyl)-2-N,2-N,2-trimethylbutane-1,2-diamine?
1-(2,6-dimethoxyphenyl)-2-N,2-N,2-trimethylbutane-1,2-diamine has a molecular weight of 266.38 g/mol, XLogP of 2.43, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-dimethoxyphenyl)-2-N,2-N,2-trimethylbutane-1,2-diamine is sourced from PubChem (CID 116810559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).