N-ethenyl-2-(prop-2-enylideneamino)propan-1-amine

C8H14N2 — CID 126625670

IUPACN-ethenyl-2-(prop-2-enylideneamino)propan-1-amine
SMILESC=C/C=N/C(C)CNC=C
InChIInChI=1S/C8H14N2/c1-4-6-10-8(3)7-9-5-2/h4-6,8-9H,1-2,7H2,3H3/b10-6+
InChIKeyOARIYROODKAIBG-UXBLZVDNSA-N
MW138.21 g/mol
LogP1.36
Rot. Bonds5

About N-ethenyl-2-(prop-2-enylideneamino)propan-1-amine

N-ethenyl-2-(prop-2-enylideneamino)propan-1-amine (PubChem CID 126625670) has the molecular formula C8H14N2 and a molecular weight of 138.21 g/mol. Its IUPAC name is N-ethenyl-2-(prop-2-enylideneamino)propan-1-amine.

Molecular Properties

Compound NameN-ethenyl-2-(prop-2-enylideneamino)propan-1-amine
PubChem CID126625670
Molecular FormulaC8H14N2
Molecular Weight138.21 g/mol
Exact Mass138.12
IUPAC NameN-ethenyl-2-(prop-2-enylideneamino)propan-1-amine
SMILESC=C/C=N/C(C)CNC=C
InChIInChI=1S/C8H14N2/c1-4-6-10-8(3)7-9-5-2/h4-6,8-9H,1-2,7H2,3H3/b10-6+
InChIKeyOARIYROODKAIBG-UXBLZVDNSA-N
XLogP1.36
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 51.36
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 N-ethenyl-2-(prop-2-enylideneamino)propan-1-amine?
The IUPAC name of N-ethenyl-2-(prop-2-enylideneamino)propan-1-amine (CID 126625670) is N-ethenyl-2-(prop-2-enylideneamino)propan-1-amine.
What is the SMILES notation for N-ethenyl-2-(prop-2-enylideneamino)propan-1-amine?
The canonical SMILES for N-ethenyl-2-(prop-2-enylideneamino)propan-1-amine is C=C/C=N/C(C)CNC=C.
What is the InChIKey of N-ethenyl-2-(prop-2-enylideneamino)propan-1-amine?
The InChIKey is OARIYROODKAIBG-UXBLZVDNSA-N. The full InChI is InChI=1S/C8H14N2/c1-4-6-10-8(3)7-9-5-2/h4-6,8-9H,1-2,7H2,3H3/b10-6+.
What are the key properties of N-ethenyl-2-(prop-2-enylideneamino)propan-1-amine?
N-ethenyl-2-(prop-2-enylideneamino)propan-1-amine has a molecular weight of 138.21 g/mol, XLogP of 1.36, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenyl-2-(prop-2-enylideneamino)propan-1-amine is sourced from PubChem (CID 126625670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).