molecular hydrogen;N-[(Z)-prop-2-enylideneamino]ethanamine

C5H12N2 — CID 143460131

IUPACmolecular hydrogen;N-[(Z)-prop-2-enylideneamino]ethanamine
SMILESC=C/C=N\NCC.[H][H]
InChIInChI=1S/C5H10N2.H2/c1-3-5-7-6-4-2;/h3,5-6H,1,4H2,2H3;1H/b7-5-;
InChIKeyYIFGXXVUNQLYFV-YJOCEBFMSA-N
MW100.16 g/mol
LogP1.01
Rot. Bonds3

About molecular hydrogen;N-[(Z)-prop-2-enylideneamino]ethanamine

molecular hydrogen;N-[(Z)-prop-2-enylideneamino]ethanamine (PubChem CID 143460131) has the molecular formula C5H12N2 and a molecular weight of 100.16 g/mol. Its IUPAC name is molecular hydrogen;N-[(Z)-prop-2-enylideneamino]ethanamine.

Molecular Properties

Compound Namemolecular hydrogen;N-[(Z)-prop-2-enylideneamino]ethanamine
PubChem CID143460131
Molecular FormulaC5H12N2
Molecular Weight100.16 g/mol
Exact Mass100.10
IUPAC Namemolecular hydrogen;N-[(Z)-prop-2-enylideneamino]ethanamine
SMILESC=C/C=N\NCC.[H][H]
InChIInChI=1S/C5H10N2.H2/c1-3-5-7-6-4-2;/h3,5-6H,1,4H2,2H3;1H/b7-5-;
InChIKeyYIFGXXVUNQLYFV-YJOCEBFMSA-N
XLogP1.01
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500100.16
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[(Z)-prop-2-enylideneamino]propan-1-amine
CID 166786300
N-[(Z)-2-methylprop-2-enylideneamino]ethanamine
CID 118153029
(3Z)-3-(ethylhydrazinylidene)-N-methylpropan-1-amine
CID 172983125
butane;N-prop-1-en-2-ylprop-2-en-1-imine
CID 144787234
N-ethyl-4-(prop-2-enylideneamino)but-3-enamide
CID 123947374
N'-[(2Z)-2-(ethylhydrazinylidene)ethyl]-N-methylmethanediamine
CID 172981341
N-[(Z)-butylideneamino]propan-1-amine
CID 5369173
N-methyl-N-[(E)-prop-2-enylideneamino]ethanamine
CID 90211188
N-methyl-2-(prop-2-enylideneamino)ethanamine
CID 143321969
(Z)-N-(ethyldiazenyl)prop-2-en-1-imine
CID 143328990
(1S)-2,2-dimethyl-1-[(Z)-prop-2-enylideneamino]butan-1-amine
CID 178053040
(E)-N-propoxyprop-2-en-1-imine
CID 10057470

Frequently Asked Questions

What is the IUPAC name of molecular hydrogen;N-[(Z)-prop-2-enylideneamino]ethanamine?
The IUPAC name of molecular hydrogen;N-[(Z)-prop-2-enylideneamino]ethanamine (CID 143460131) is molecular hydrogen;N-[(Z)-prop-2-enylideneamino]ethanamine.
What is the SMILES notation for molecular hydrogen;N-[(Z)-prop-2-enylideneamino]ethanamine?
The canonical SMILES for molecular hydrogen;N-[(Z)-prop-2-enylideneamino]ethanamine is C=C/C=N\NCC.[H][H].
What is the InChIKey of molecular hydrogen;N-[(Z)-prop-2-enylideneamino]ethanamine?
The InChIKey is YIFGXXVUNQLYFV-YJOCEBFMSA-N. The full InChI is InChI=1S/C5H10N2.H2/c1-3-5-7-6-4-2;/h3,5-6H,1,4H2,2H3;1H/b7-5-;.
What are the key properties of molecular hydrogen;N-[(Z)-prop-2-enylideneamino]ethanamine?
molecular hydrogen;N-[(Z)-prop-2-enylideneamino]ethanamine has a molecular weight of 100.16 g/mol, XLogP of 1.01, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for molecular hydrogen;N-[(Z)-prop-2-enylideneamino]ethanamine is sourced from PubChem (CID 143460131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).