2-N-(3-methoxy-3-methylbutyl)-1-N,1-N-dimethylpropane-1,2-diamine

C11H26N2O — CID 103019955

IUPAC2-N-(3-methoxy-3-methylbutyl)-1-N,1-N-dimethylpropane-1,2-diamine
SMILESCOC(C)(C)CCNC(C)CN(C)C
InChIInChI=1S/C11H26N2O/c1-10(9-13(4)5)12-8-7-11(2,3)14-6/h10,12H,7-9H2,1-6H3
InChIKeyOFWSGMQACBRRLN-UHFFFAOYSA-N
MW202.34 g/mol
LogP1.34
Rot. Bonds7

About 2-N-(3-methoxy-3-methylbutyl)-1-N,1-N-dimethylpropane-1,2-diamine

2-N-(3-methoxy-3-methylbutyl)-1-N,1-N-dimethylpropane-1,2-diamine (PubChem CID 103019955) has the molecular formula C11H26N2O and a molecular weight of 202.34 g/mol. Its IUPAC name is 2-N-(3-methoxy-3-methylbutyl)-1-N,1-N-dimethylpropane-1,2-diamine.

Molecular Properties

Compound Name2-N-(3-methoxy-3-methylbutyl)-1-N,1-N-dimethylpropane-1,2-diamine
PubChem CID103019955
Molecular FormulaC11H26N2O
Molecular Weight202.34 g/mol
Exact Mass202.20
IUPAC Name2-N-(3-methoxy-3-methylbutyl)-1-N,1-N-dimethylpropane-1,2-diamine
SMILESCOC(C)(C)CCNC(C)CN(C)C
InChIInChI=1S/C11H26N2O/c1-10(9-13(4)5)12-8-7-11(2,3)14-6/h10,12H,7-9H2,1-6H3
InChIKeyOFWSGMQACBRRLN-UHFFFAOYSA-N
XLogP1.34
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.34
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(3-methoxy-3-methylbutyl)amino]propan-1-ol
CID 103019922
2-N-(4-methoxy-4-methylpentan-2-yl)-1-N,1-N-dimethylpropane-1,2-diamine
CID 82945735
N-(1-ethoxypropan-2-yl)-3-methoxy-3-methylbutan-1-amine
CID 103033262
5-chloro-N-(3-methoxy-3-methylbutyl)pentan-2-amine
CID 103037206
N-(3,3-dimethylbutyl)-4-methoxy-4-methylpentan-2-amine
CID 115712795
1-N,1-N-dimethyl-2-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]propane-1,2-diamine
CID 112589367
N-(1,1-dimethoxypropan-2-yl)-3-methoxy-3-methylbutan-1-amine
CID 106675441
4-methoxy-4-methyl-N-(3,3,3-trifluoropropyl)pentan-2-amine
CID 63226548
1-N-cyclopropyl-2-N-(3-methoxy-3-methylbutyl)propane-1,2-diamine
CID 103019940
2-N-ethyl-1-N,1-N-dimethylpropane-1,2-diamine
CID 23008779
methyl 2-[(3-methoxy-3-methylbutyl)amino]propanoate
CID 103033239
N-[1-(4-bromophenyl)propan-2-yl]-3-methoxy-3-methylbutan-1-amine
CID 106675197

Frequently Asked Questions

What is the IUPAC name of 2-N-(3-methoxy-3-methylbutyl)-1-N,1-N-dimethylpropane-1,2-diamine?
The IUPAC name of 2-N-(3-methoxy-3-methylbutyl)-1-N,1-N-dimethylpropane-1,2-diamine (CID 103019955) is 2-N-(3-methoxy-3-methylbutyl)-1-N,1-N-dimethylpropane-1,2-diamine.
What is the SMILES notation for 2-N-(3-methoxy-3-methylbutyl)-1-N,1-N-dimethylpropane-1,2-diamine?
The canonical SMILES for 2-N-(3-methoxy-3-methylbutyl)-1-N,1-N-dimethylpropane-1,2-diamine is COC(C)(C)CCNC(C)CN(C)C.
What is the InChIKey of 2-N-(3-methoxy-3-methylbutyl)-1-N,1-N-dimethylpropane-1,2-diamine?
The InChIKey is OFWSGMQACBRRLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26N2O/c1-10(9-13(4)5)12-8-7-11(2,3)14-6/h10,12H,7-9H2,1-6H3.
What are the key properties of 2-N-(3-methoxy-3-methylbutyl)-1-N,1-N-dimethylpropane-1,2-diamine?
2-N-(3-methoxy-3-methylbutyl)-1-N,1-N-dimethylpropane-1,2-diamine has a molecular weight of 202.34 g/mol, XLogP of 1.34, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(3-methoxy-3-methylbutyl)-1-N,1-N-dimethylpropane-1,2-diamine is sourced from PubChem (CID 103019955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).