1-(ethylideneamino)ethanamine

C4H10N2 — CID 71330898

IUPAC1-(ethylideneamino)ethanamine
SMILESCC=NC(C)N
InChIInChI=1S/C4H10N2/c1-3-6-4(2)5/h3-4H,5H2,1-2H3
InChIKeyBPKQWAXFMKJIGP-UHFFFAOYSA-N
MW86.14 g/mol
LogP0.38
Rot. Bonds1

About 1-(ethylideneamino)ethanamine

1-(ethylideneamino)ethanamine (PubChem CID 71330898) has the molecular formula C4H10N2 and a molecular weight of 86.14 g/mol. Its IUPAC name is 1-(ethylideneamino)ethanamine.

Molecular Properties

Compound Name1-(ethylideneamino)ethanamine
PubChem CID71330898
Molecular FormulaC4H10N2
Molecular Weight86.14 g/mol
Exact Mass86.08
IUPAC Name1-(ethylideneamino)ethanamine
SMILESCC=NC(C)N
InChIInChI=1S/C4H10N2/c1-3-6-4(2)5/h3-4H,5H2,1-2H3
InChIKeyBPKQWAXFMKJIGP-UHFFFAOYSA-N
XLogP0.38
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50086.14
LogP ≤ 50.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-(ethylideneamino)ethanamine?
The IUPAC name of 1-(ethylideneamino)ethanamine (CID 71330898) is 1-(ethylideneamino)ethanamine.
What is the SMILES notation for 1-(ethylideneamino)ethanamine?
The canonical SMILES for 1-(ethylideneamino)ethanamine is CC=NC(C)N.
What is the InChIKey of 1-(ethylideneamino)ethanamine?
The InChIKey is BPKQWAXFMKJIGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10N2/c1-3-6-4(2)5/h3-4H,5H2,1-2H3.
What are the key properties of 1-(ethylideneamino)ethanamine?
1-(ethylideneamino)ethanamine has a molecular weight of 86.14 g/mol, XLogP of 0.38, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(ethylideneamino)ethanamine is sourced from PubChem (CID 71330898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).