ethane;N-methyl-N',N'-di(propan-2-yl)ethane-1,2-diamine

C11H28N2 — CID 142040763

IUPACethane;N-methyl-N',N'-di(propan-2-yl)ethane-1,2-diamine
SMILESCC.CNCCN(C(C)C)C(C)C
InChIInChI=1S/C9H22N2.C2H6/c1-8(2)11(9(3)4)7-6-10-5;1-2/h8-10H,6-7H2,1-5H3;1-2H3
InChIKeyOCHQAXIZTAHNFL-UHFFFAOYSA-N
MW188.36 g/mol
LogP2.35
Rot. Bonds5

About ethane;N-methyl-N',N'-di(propan-2-yl)ethane-1,2-diamine

ethane;N-methyl-N',N'-di(propan-2-yl)ethane-1,2-diamine (PubChem CID 142040763) has the molecular formula C11H28N2 and a molecular weight of 188.36 g/mol. Its IUPAC name is ethane;N-methyl-N',N'-di(propan-2-yl)ethane-1,2-diamine.

Molecular Properties

Compound Nameethane;N-methyl-N',N'-di(propan-2-yl)ethane-1,2-diamine
PubChem CID142040763
Molecular FormulaC11H28N2
Molecular Weight188.36 g/mol
Exact Mass188.23
IUPAC Nameethane;N-methyl-N',N'-di(propan-2-yl)ethane-1,2-diamine
SMILESCC.CNCCN(C(C)C)C(C)C
InChIInChI=1S/C9H22N2.C2H6/c1-8(2)11(9(3)4)7-6-10-5;1-2/h8-10H,6-7H2,1-5H3;1-2H3
InChIKeyOCHQAXIZTAHNFL-UHFFFAOYSA-N
XLogP2.35
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.36
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[1-hydroxyethyl-[2-(methylamino)ethyl]amino]ethanol
CID 140991632
1-[2-[di(propan-2-yl)amino]ethylsulfamoyl-methylamino]-3-(methylamino)propane
CID 106041029
N-methyl-N'-[2-[2-(methylamino)ethyl-propan-2-ylamino]ethyl]ethane-1,2-diamine
CID 176601082
lithium;hydride;N,N',N'-trimethylethane-1,2-diamine
CID 173063979
N',N'-diethyl-N-methylethane-1,2-diamine;ethane
CID 142004273
2-[propan-2-yl-[2-(sulfinoamino)ethyl]amino]propane
CID 57206059
2-[propan-2-yl-[2-(sulfinatoamino)ethyl]amino]propane
CID 57206058
N',N'-di(propan-2-yl)-N-(silyloxymethyl)ethane-1,2-diamine
CID 123361702
N-[2-[di(propan-2-yl)amino]ethyl]-N'-methylmethanimidamide
CID 89221528
N-(3-fluoropropyl)-N',N'-di(propan-2-yl)ethane-1,2-diamine
CID 81106048
ethane;propane;N,N',N'-trimethylethane-1,2-diamine
CID 143559684
2,3-dimethylbutane;N',N'-di(propan-2-yl)ethane-1,2-diamine
CID 87486817

Frequently Asked Questions

What is the IUPAC name of ethane;N-methyl-N',N'-di(propan-2-yl)ethane-1,2-diamine?
The IUPAC name of ethane;N-methyl-N',N'-di(propan-2-yl)ethane-1,2-diamine (CID 142040763) is ethane;N-methyl-N',N'-di(propan-2-yl)ethane-1,2-diamine.
What is the SMILES notation for ethane;N-methyl-N',N'-di(propan-2-yl)ethane-1,2-diamine?
The canonical SMILES for ethane;N-methyl-N',N'-di(propan-2-yl)ethane-1,2-diamine is CC.CNCCN(C(C)C)C(C)C.
What is the InChIKey of ethane;N-methyl-N',N'-di(propan-2-yl)ethane-1,2-diamine?
The InChIKey is OCHQAXIZTAHNFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H22N2.C2H6/c1-8(2)11(9(3)4)7-6-10-5;1-2/h8-10H,6-7H2,1-5H3;1-2H3.
What are the key properties of ethane;N-methyl-N',N'-di(propan-2-yl)ethane-1,2-diamine?
ethane;N-methyl-N',N'-di(propan-2-yl)ethane-1,2-diamine has a molecular weight of 188.36 g/mol, XLogP of 2.35, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-methyl-N',N'-di(propan-2-yl)ethane-1,2-diamine is sourced from PubChem (CID 142040763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).