1-[[(Z)-1-aminoprop-1-en-2-yl]amino]ethenol

C5H10N2O — CID 89043965

IUPAC1-[[(Z)-1-aminoprop-1-en-2-yl]amino]ethenol
SMILESC=C(O)N/C(C)=C\N
InChIInChI=1S/C5H10N2O/c1-4(3-6)7-5(2)8/h3,7-8H,2,6H2,1H3/b4-3-
InChIKeyPHJCUDXWSOWGQS-ARJAWSKDSA-N
MW114.15 g/mol
LogP0.43
Rot. Bonds2

About 1-[[(Z)-1-aminoprop-1-en-2-yl]amino]ethenol

1-[[(Z)-1-aminoprop-1-en-2-yl]amino]ethenol (PubChem CID 89043965) has the molecular formula C5H10N2O and a molecular weight of 114.15 g/mol. Its IUPAC name is 1-[[(Z)-1-aminoprop-1-en-2-yl]amino]ethenol.

Molecular Properties

Compound Name1-[[(Z)-1-aminoprop-1-en-2-yl]amino]ethenol
PubChem CID89043965
Molecular FormulaC5H10N2O
Molecular Weight114.15 g/mol
Exact Mass114.08
IUPAC Name1-[[(Z)-1-aminoprop-1-en-2-yl]amino]ethenol
SMILESC=C(O)N/C(C)=C\N
InChIInChI=1S/C5H10N2O/c1-4(3-6)7-5(2)8/h3,7-8H,2,6H2,1H3/b4-3-
InChIKeyPHJCUDXWSOWGQS-ARJAWSKDSA-N
XLogP0.43
TPSA58.28 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.15
LogP ≤ 50.43
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-[[(Z)-1-aminoprop-1-en-2-yl]amino]ethenol?
The IUPAC name of 1-[[(Z)-1-aminoprop-1-en-2-yl]amino]ethenol (CID 89043965) is 1-[[(Z)-1-aminoprop-1-en-2-yl]amino]ethenol.
What is the SMILES notation for 1-[[(Z)-1-aminoprop-1-en-2-yl]amino]ethenol?
The canonical SMILES for 1-[[(Z)-1-aminoprop-1-en-2-yl]amino]ethenol is C=C(O)N/C(C)=C\N.
What is the InChIKey of 1-[[(Z)-1-aminoprop-1-en-2-yl]amino]ethenol?
The InChIKey is PHJCUDXWSOWGQS-ARJAWSKDSA-N. The full InChI is InChI=1S/C5H10N2O/c1-4(3-6)7-5(2)8/h3,7-8H,2,6H2,1H3/b4-3-.
What are the key properties of 1-[[(Z)-1-aminoprop-1-en-2-yl]amino]ethenol?
1-[[(Z)-1-aminoprop-1-en-2-yl]amino]ethenol has a molecular weight of 114.15 g/mol, XLogP of 0.43, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[(Z)-1-aminoprop-1-en-2-yl]amino]ethenol is sourced from PubChem (CID 89043965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).