1-N-(4,4-dimethylpent-1-en-2-yl)-2-N-methylprop-2-ene-1,2-diamine

C11H22N2 — CID 138734225

IUPAC1-N-(4,4-dimethylpent-1-en-2-yl)-2-N-methylprop-2-ene-1,2-diamine
SMILESC=C(CNC(=C)CC(C)(C)C)NC
InChIInChI=1S/C11H22N2/c1-9(7-11(3,4)5)13-8-10(2)12-6/h12-13H,1-2,7-8H2,3-6H3
InChIKeyZWUDOFJTKURCER-UHFFFAOYSA-N
MW182.31 g/mol
LogP2.26
Rot. Bonds5

About 1-N-(4,4-dimethylpent-1-en-2-yl)-2-N-methylprop-2-ene-1,2-diamine

1-N-(4,4-dimethylpent-1-en-2-yl)-2-N-methylprop-2-ene-1,2-diamine (PubChem CID 138734225) has the molecular formula C11H22N2 and a molecular weight of 182.31 g/mol. Its IUPAC name is 1-N-(4,4-dimethylpent-1-en-2-yl)-2-N-methylprop-2-ene-1,2-diamine.

Molecular Properties

Compound Name1-N-(4,4-dimethylpent-1-en-2-yl)-2-N-methylprop-2-ene-1,2-diamine
PubChem CID138734225
Molecular FormulaC11H22N2
Molecular Weight182.31 g/mol
Exact Mass182.18
IUPAC Name1-N-(4,4-dimethylpent-1-en-2-yl)-2-N-methylprop-2-ene-1,2-diamine
SMILESC=C(CNC(=C)CC(C)(C)C)NC
InChIInChI=1S/C11H22N2/c1-9(7-11(3,4)5)13-8-10(2)12-6/h12-13H,1-2,7-8H2,3-6H3
InChIKeyZWUDOFJTKURCER-UHFFFAOYSA-N
XLogP2.26
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4,4-dimethylpent-1-en-2-yl)-N'-(3,3,3-trifluoroprop-1-en-2-yl)butane-1,4-diamine
CID 134441684
1-N,2-N-bis(4,4-dimethylpent-1-en-2-yl)-3,3,3-trifluoropropane-1,2-diamine
CID 174329365
1-(3,3-Dimethylpent-1-en-2-yl)piperazine
CID 18717508
1,7,7-Trimethyl-8-methylidene-1,4-diazocane
CID 57785857
2-N-(2-methylpent-1-en-3-yl)-3-N-prop-1-en-2-ylpent-1-ene-2,3-diamine
CID 58987143
N-butyl-3,3-dimethylpent-1-en-2-amine
CID 59096553
N,4,4-trimethylpent-1-en-2-amine
CID 59850104
N-(3,3-dimethylpent-1-en-2-yl)-N',N'-dimethylpropane-1,3-diamine
CID 87103401
(Z)-1-N-(3,3-dimethylpent-1-en-2-yl)-1-N-ethylbut-1-ene-1,2-diamine
CID 88867652
N-(3,3-dimethylpent-1-en-2-yl)-N'-(2-methylbutan-2-yl)ethane-1,2-diamine
CID 89100894
N'-pent-1-en-2-ylethane-1,2-diamine
CID 89152133
4,4-dimethyl-N-propan-2-ylpent-1-en-2-amine
CID 89707026

Frequently Asked Questions

What is the IUPAC name of 1-N-(4,4-dimethylpent-1-en-2-yl)-2-N-methylprop-2-ene-1,2-diamine?
The IUPAC name of 1-N-(4,4-dimethylpent-1-en-2-yl)-2-N-methylprop-2-ene-1,2-diamine (CID 138734225) is 1-N-(4,4-dimethylpent-1-en-2-yl)-2-N-methylprop-2-ene-1,2-diamine.
What is the SMILES notation for 1-N-(4,4-dimethylpent-1-en-2-yl)-2-N-methylprop-2-ene-1,2-diamine?
The canonical SMILES for 1-N-(4,4-dimethylpent-1-en-2-yl)-2-N-methylprop-2-ene-1,2-diamine is C=C(CNC(=C)CC(C)(C)C)NC.
What is the InChIKey of 1-N-(4,4-dimethylpent-1-en-2-yl)-2-N-methylprop-2-ene-1,2-diamine?
The InChIKey is ZWUDOFJTKURCER-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2/c1-9(7-11(3,4)5)13-8-10(2)12-6/h12-13H,1-2,7-8H2,3-6H3.
What are the key properties of 1-N-(4,4-dimethylpent-1-en-2-yl)-2-N-methylprop-2-ene-1,2-diamine?
1-N-(4,4-dimethylpent-1-en-2-yl)-2-N-methylprop-2-ene-1,2-diamine has a molecular weight of 182.31 g/mol, XLogP of 2.26, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-(4,4-dimethylpent-1-en-2-yl)-2-N-methylprop-2-ene-1,2-diamine is sourced from PubChem (CID 138734225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).