1-N,1-N'-dimethyl-1-N'-[(Z)-prop-1-enyl]ethane-1,1-diamine

C7H16N2 — CID 126633418

IUPAC1-N,1-N'-dimethyl-1-N'-[(Z)-prop-1-enyl]ethane-1,1-diamine
SMILESC/C=C\N(C)C(C)NC
InChIInChI=1S/C7H16N2/c1-5-6-9(4)7(2)8-3/h5-8H,1-4H3/b6-5-
InChIKeyPMKHIWIWMPFHLI-WAYWQWQTSA-N
MW128.22 g/mol
LogP1.02
Rot. Bonds3

About 1-N,1-N'-dimethyl-1-N'-[(Z)-prop-1-enyl]ethane-1,1-diamine

1-N,1-N'-dimethyl-1-N'-[(Z)-prop-1-enyl]ethane-1,1-diamine (PubChem CID 126633418) has the molecular formula C7H16N2 and a molecular weight of 128.22 g/mol. Its IUPAC name is 1-N,1-N'-dimethyl-1-N'-[(Z)-prop-1-enyl]ethane-1,1-diamine.

Molecular Properties

Compound Name1-N,1-N'-dimethyl-1-N'-[(Z)-prop-1-enyl]ethane-1,1-diamine
PubChem CID126633418
Molecular FormulaC7H16N2
Molecular Weight128.22 g/mol
Exact Mass128.13
IUPAC Name1-N,1-N'-dimethyl-1-N'-[(Z)-prop-1-enyl]ethane-1,1-diamine
SMILESC/C=C\N(C)C(C)NC
InChIInChI=1S/C7H16N2/c1-5-6-9(4)7(2)8-3/h5-8H,1-4H3/b6-5-
InChIKeyPMKHIWIWMPFHLI-WAYWQWQTSA-N
XLogP1.02
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.22
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze 1-N,1-N'-dimethyl-1-N'-[(Z)-prop-1-enyl]ethane-1,1-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1,2-dimethyl-1-prop-1-enylhydrazine
CID 123432915
1,3-dimethyl-1-[(E)-prop-1-enyl]urea
CID 44554794
(Z)-N'-methyl-N'-propan-2-yl-N-[(Z)-prop-1-enyl]ethene-1,2-diamine
CID 170126340
3-N-ethenyl-2-N-methyl-3-N-[(Z)-prop-1-enyl]but-1-ene-2,3-diamine
CID 162389547
N,N',N',N",N"-pentamethylmethanetriamine
CID 118529087
(Z)-N,3-dimethyl-N-[(Z)-prop-1-enyl]but-1-en-1-amine;ethane
CID 142053710
(6Z)-N,4-dimethyl-5-methylidene-N-[(E)-prop-1-enyl]octa-1,6-dien-3-amine
CID 143570235
1-propan-2-yl-1-[(Z)-prop-1-enyl]hydrazine
CID 139357350
(Z)-N-methyl-N-phosphanylprop-1-en-1-amine
CID 146478615
N-methyl-N-[(Z)-prop-1-enyl]hydroxylamine
CID 144947013
bis(N,N-dimethylprop-1-en-1-amine);methanamine
CID 175199279
(Z)-but-2-ene;ethane;(E)-N-methylpent-3-en-2-amine
CID 142924416

Frequently Asked Questions

What is the IUPAC name of 1-N,1-N'-dimethyl-1-N'-[(Z)-prop-1-enyl]ethane-1,1-diamine?
The IUPAC name of 1-N,1-N'-dimethyl-1-N'-[(Z)-prop-1-enyl]ethane-1,1-diamine (CID 126633418) is 1-N,1-N'-dimethyl-1-N'-[(Z)-prop-1-enyl]ethane-1,1-diamine.
What is the SMILES notation for 1-N,1-N'-dimethyl-1-N'-[(Z)-prop-1-enyl]ethane-1,1-diamine?
The canonical SMILES for 1-N,1-N'-dimethyl-1-N'-[(Z)-prop-1-enyl]ethane-1,1-diamine is C/C=C\N(C)C(C)NC.
What is the InChIKey of 1-N,1-N'-dimethyl-1-N'-[(Z)-prop-1-enyl]ethane-1,1-diamine?
The InChIKey is PMKHIWIWMPFHLI-WAYWQWQTSA-N. The full InChI is InChI=1S/C7H16N2/c1-5-6-9(4)7(2)8-3/h5-8H,1-4H3/b6-5-.
What are the key properties of 1-N,1-N'-dimethyl-1-N'-[(Z)-prop-1-enyl]ethane-1,1-diamine?
1-N,1-N'-dimethyl-1-N'-[(Z)-prop-1-enyl]ethane-1,1-diamine has a molecular weight of 128.22 g/mol, XLogP of 1.02, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,1-N'-dimethyl-1-N'-[(Z)-prop-1-enyl]ethane-1,1-diamine is sourced from PubChem (CID 126633418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).