ethane;1-methoxy-3-methylbutane;N,N,N',N'-tetramethylethane-1,2-diamine

C16H42N2O — CID 166093822

IUPACethane;1-methoxy-3-methylbutane;N,N,N',N'-tetramethylethane-1,2-diamine
SMILESCC.CC.CN(C)CCN(C)C.COCCC(C)C
InChIInChI=1S/C6H16N2.C6H14O.2C2H6/c1-7(2)5-6-8(3)4;1-6(2)4-5-7-3;2*1-2/h5-6H2,1-4H3;6H,4-5H2,1-3H3;2*1-2H3
InChIKeyVILKMIPRKWCLGK-UHFFFAOYSA-N
MW278.52 g/mol
LogP3.84
Rot. Bonds6

About ethane;1-methoxy-3-methylbutane;N,N,N',N'-tetramethylethane-1,2-diamine

ethane;1-methoxy-3-methylbutane;N,N,N',N'-tetramethylethane-1,2-diamine (PubChem CID 166093822) has the molecular formula C16H42N2O and a molecular weight of 278.52 g/mol. Its IUPAC name is ethane;1-methoxy-3-methylbutane;N,N,N',N'-tetramethylethane-1,2-diamine.

Molecular Properties

Compound Nameethane;1-methoxy-3-methylbutane;N,N,N',N'-tetramethylethane-1,2-diamine
PubChem CID166093822
Molecular FormulaC16H42N2O
Molecular Weight278.52 g/mol
Exact Mass278.33
IUPAC Nameethane;1-methoxy-3-methylbutane;N,N,N',N'-tetramethylethane-1,2-diamine
SMILESCC.CC.CN(C)CCN(C)C.COCCC(C)C
InChIInChI=1S/C6H16N2.C6H14O.2C2H6/c1-7(2)5-6-8(3)4;1-6(2)4-5-7-3;2*1-2/h5-6H2,1-4H3;6H,4-5H2,1-3H3;2*1-2H3
InChIKeyVILKMIPRKWCLGK-UHFFFAOYSA-N
XLogP3.84
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.52
LogP ≤ 53.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-1-(2-methylbutoxy)butane;N,N,N',N'-tetrakis(2-methylpropyl)ethane-1,2-diamine
CID 54515766
N,N,N',N'-tetrakis(2-methylpropoxymethyl)ethane-1,2-diamine
CID 88535327
1-methoxy-2-methylpropane;2-methylbutane;tris(rutherfordium);N,N,2-trimethylpropan-1-amine
CID 157950176
methane;1-methoxy-2-methylpropane;2-methylbutane;tris(rutherfordium);N,N,2-trimethylpropan-1-amine
CID 159391159
Ethane;1-ethyl-4-methylpiperazine;1-methoxy-3-methylbutane
CID 166092530

Frequently Asked Questions

What is the IUPAC name of ethane;1-methoxy-3-methylbutane;N,N,N',N'-tetramethylethane-1,2-diamine?
The IUPAC name of ethane;1-methoxy-3-methylbutane;N,N,N',N'-tetramethylethane-1,2-diamine (CID 166093822) is ethane;1-methoxy-3-methylbutane;N,N,N',N'-tetramethylethane-1,2-diamine.
What is the SMILES notation for ethane;1-methoxy-3-methylbutane;N,N,N',N'-tetramethylethane-1,2-diamine?
The canonical SMILES for ethane;1-methoxy-3-methylbutane;N,N,N',N'-tetramethylethane-1,2-diamine is CC.CC.CN(C)CCN(C)C.COCCC(C)C.
What is the InChIKey of ethane;1-methoxy-3-methylbutane;N,N,N',N'-tetramethylethane-1,2-diamine?
The InChIKey is VILKMIPRKWCLGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H16N2.C6H14O.2C2H6/c1-7(2)5-6-8(3)4;1-6(2)4-5-7-3;2*1-2/h5-6H2,1-4H3;6H,4-5H2,1-3H3;2*1-2H3.
What are the key properties of ethane;1-methoxy-3-methylbutane;N,N,N',N'-tetramethylethane-1,2-diamine?
ethane;1-methoxy-3-methylbutane;N,N,N',N'-tetramethylethane-1,2-diamine has a molecular weight of 278.52 g/mol, XLogP of 3.84, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-methoxy-3-methylbutane;N,N,N',N'-tetramethylethane-1,2-diamine is sourced from PubChem (CID 166093822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).