1-N,2-N-dimethyl-2-N-prop-2-enylprop-2-ene-1,2-diamine

C8H16N2 — CID 153334785

IUPAC1-N,2-N-dimethyl-2-N-prop-2-enylprop-2-ene-1,2-diamine
SMILESC=CCN(C)C(=C)CNC
InChIInChI=1S/C8H16N2/c1-5-6-10(4)8(2)7-9-3/h5,9H,1-2,6-7H2,3-4H3
InChIKeyKUKANSLMSHWFBB-UHFFFAOYSA-N
MW140.23 g/mol
LogP0.84
Rot. Bonds5

About 1-N,2-N-dimethyl-2-N-prop-2-enylprop-2-ene-1,2-diamine

1-N,2-N-dimethyl-2-N-prop-2-enylprop-2-ene-1,2-diamine (PubChem CID 153334785) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is 1-N,2-N-dimethyl-2-N-prop-2-enylprop-2-ene-1,2-diamine.

Molecular Properties

Compound Name1-N,2-N-dimethyl-2-N-prop-2-enylprop-2-ene-1,2-diamine
PubChem CID153334785
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC Name1-N,2-N-dimethyl-2-N-prop-2-enylprop-2-ene-1,2-diamine
SMILESC=CCN(C)C(=C)CNC
InChIInChI=1S/C8H16N2/c1-5-6-10(4)8(2)7-9-3/h5,9H,1-2,6-7H2,3-4H3
InChIKeyKUKANSLMSHWFBB-UHFFFAOYSA-N
XLogP0.84
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N,N'-dimethyl-N,N'-bis(prop-2-enyl)oxamide
CID 71483404
methyl N-methyl-N-prop-2-enylcarbamate
CID 116657055
2-fluoro-N-methyl-N-prop-2-enylprop-2-enamide
CID 139381351
2-[methyl(prop-2-enyl)amino]-2-oxoacetic acid
CID 71699730
2-ethyl-N,2-dimethyl-N-prop-2-enylbutanamide
CID 14248676
1-ethyl-1,3-dimethyl-3-prop-2-enylurea
CID 116657053
methanesulfonic acid;N-methyl-N-prop-2-enylprop-2-en-1-amine
CID 89483061
N-methyl-N-prop-2-enylprop-2-en-1-amine;hydroiodide
CID 141311417
azane;N,N-dimethylprop-2-en-1-amine
CID 87892299
N,N-dimethylprop-2-en-1-amine;ethane-1,2-diol
CID 87069649
propan-2-yl N-methyl-N-prop-2-enylcarbamate
CID 116657045
2-bromo-N-methyl-N-prop-2-enylprop-2-en-1-amine
CID 13113536

Frequently Asked Questions

What is the IUPAC name of 1-N,2-N-dimethyl-2-N-prop-2-enylprop-2-ene-1,2-diamine?
The IUPAC name of 1-N,2-N-dimethyl-2-N-prop-2-enylprop-2-ene-1,2-diamine (CID 153334785) is 1-N,2-N-dimethyl-2-N-prop-2-enylprop-2-ene-1,2-diamine.
What is the SMILES notation for 1-N,2-N-dimethyl-2-N-prop-2-enylprop-2-ene-1,2-diamine?
The canonical SMILES for 1-N,2-N-dimethyl-2-N-prop-2-enylprop-2-ene-1,2-diamine is C=CCN(C)C(=C)CNC.
What is the InChIKey of 1-N,2-N-dimethyl-2-N-prop-2-enylprop-2-ene-1,2-diamine?
The InChIKey is KUKANSLMSHWFBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2/c1-5-6-10(4)8(2)7-9-3/h5,9H,1-2,6-7H2,3-4H3.
What are the key properties of 1-N,2-N-dimethyl-2-N-prop-2-enylprop-2-ene-1,2-diamine?
1-N,2-N-dimethyl-2-N-prop-2-enylprop-2-ene-1,2-diamine has a molecular weight of 140.23 g/mol, XLogP of 0.84, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,2-N-dimethyl-2-N-prop-2-enylprop-2-ene-1,2-diamine is sourced from PubChem (CID 153334785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).