ethane;propane;N,N,N'-trimethyl-N'-(2-methylbutan-2-yl)ethane-1,2-diamine

C15H38N2 — CID 171506447

IUPACethane;propane;N,N,N'-trimethyl-N'-(2-methylbutan-2-yl)ethane-1,2-diamine
SMILESCC.CCC.CCC(C)(C)N(C)CCN(C)C
InChIInChI=1S/C10H24N2.C3H8.C2H6/c1-7-10(2,3)12(6)9-8-11(4)5;1-3-2;1-2/h7-9H2,1-6H3;3H2,1-2H3;1-2H3
InChIKeyCAOXZSKATVSQNW-UHFFFAOYSA-N
MW246.48 g/mol
LogP4.11
Rot. Bonds5

About ethane;propane;N,N,N'-trimethyl-N'-(2-methylbutan-2-yl)ethane-1,2-diamine

ethane;propane;N,N,N'-trimethyl-N'-(2-methylbutan-2-yl)ethane-1,2-diamine (PubChem CID 171506447) has the molecular formula C15H38N2 and a molecular weight of 246.48 g/mol. Its IUPAC name is ethane;propane;N,N,N'-trimethyl-N'-(2-methylbutan-2-yl)ethane-1,2-diamine.

Molecular Properties

Compound Nameethane;propane;N,N,N'-trimethyl-N'-(2-methylbutan-2-yl)ethane-1,2-diamine
PubChem CID171506447
Molecular FormulaC15H38N2
Molecular Weight246.48 g/mol
Exact Mass246.30
IUPAC Nameethane;propane;N,N,N'-trimethyl-N'-(2-methylbutan-2-yl)ethane-1,2-diamine
SMILESCC.CCC.CCC(C)(C)N(C)CCN(C)C
InChIInChI=1S/C10H24N2.C3H8.C2H6/c1-7-10(2,3)12(6)9-8-11(4)5;1-3-2;1-2/h7-9H2,1-6H3;3H2,1-2H3;1-2H3
InChIKeyCAOXZSKATVSQNW-UHFFFAOYSA-N
XLogP4.11
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.48
LogP ≤ 54.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-N-(2-methylbutan-2-yl)hexan-1-amine
CID 167034677
N'-hydroxy-3-[methyl(2-methylbutan-2-yl)amino]propanimidamide
CID 77014154
N,N'-dimethyl-N'-(2-methylbutan-2-yl)butane-1,4-diamine
CID 63964794
N',2-dimethyl-N'-(2-methylbutan-2-yl)butane-1,4-diamine
CID 81080379
3-[methyl(2-methylbutan-2-yl)amino]propanethioamide
CID 63983386
N'-[2-[tert-butyl(methyl)amino]ethyl]-N,N,N'-trimethylethane-1,2-diamine
CID 158891423
2-amino-2-methyl-4-[methyl(2-methylbutan-2-yl)amino]butan-1-ol
CID 64791427
N',2-dimethyl-N'-(2-methylbutan-2-yl)propane-1,3-diamine
CID 63981166
2,2-diethyl-N'-methyl-N'-(2-methylbutan-2-yl)propane-1,3-diamine
CID 63965862
N'-[2-(dimethylamino)ethyl]-N'-ethyl-N,N-dimethylethane-1,2-diamine;2-methylpropan-2-amine
CID 87733382
3-[methyl(2-methylbutan-2-yl)amino]propane-1-sulfonamide
CID 112691055
2,2-dimethyl-4-[methyl(2-methylbutan-2-yl)amino]butanethioamide
CID 65248584

Frequently Asked Questions

What is the IUPAC name of ethane;propane;N,N,N'-trimethyl-N'-(2-methylbutan-2-yl)ethane-1,2-diamine?
The IUPAC name of ethane;propane;N,N,N'-trimethyl-N'-(2-methylbutan-2-yl)ethane-1,2-diamine (CID 171506447) is ethane;propane;N,N,N'-trimethyl-N'-(2-methylbutan-2-yl)ethane-1,2-diamine.
What is the SMILES notation for ethane;propane;N,N,N'-trimethyl-N'-(2-methylbutan-2-yl)ethane-1,2-diamine?
The canonical SMILES for ethane;propane;N,N,N'-trimethyl-N'-(2-methylbutan-2-yl)ethane-1,2-diamine is CC.CCC.CCC(C)(C)N(C)CCN(C)C.
What is the InChIKey of ethane;propane;N,N,N'-trimethyl-N'-(2-methylbutan-2-yl)ethane-1,2-diamine?
The InChIKey is CAOXZSKATVSQNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N2.C3H8.C2H6/c1-7-10(2,3)12(6)9-8-11(4)5;1-3-2;1-2/h7-9H2,1-6H3;3H2,1-2H3;1-2H3.
What are the key properties of ethane;propane;N,N,N'-trimethyl-N'-(2-methylbutan-2-yl)ethane-1,2-diamine?
ethane;propane;N,N,N'-trimethyl-N'-(2-methylbutan-2-yl)ethane-1,2-diamine has a molecular weight of 246.48 g/mol, XLogP of 4.11, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;propane;N,N,N'-trimethyl-N'-(2-methylbutan-2-yl)ethane-1,2-diamine is sourced from PubChem (CID 171506447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).