(Z)-1-(1-aminoethenoxy)prop-1-en-2-amine

C5H10N2O — CID 130441321

IUPAC(Z)-1-(1-aminoethenoxy)prop-1-en-2-amine
SMILESC=C(N)O/C=C(/C)N
InChIInChI=1S/C5H10N2O/c1-4(6)3-8-5(2)7/h3H,2,6-7H2,1H3/b4-3-
InChIKeyLJDKNJDVSVWBFT-ARJAWSKDSA-N
MW114.15 g/mol
LogP0.25
Rot. Bonds2

About (Z)-1-(1-aminoethenoxy)prop-1-en-2-amine

(Z)-1-(1-aminoethenoxy)prop-1-en-2-amine (PubChem CID 130441321) has the molecular formula C5H10N2O and a molecular weight of 114.15 g/mol. Its IUPAC name is (Z)-1-(1-aminoethenoxy)prop-1-en-2-amine.

Molecular Properties

Compound Name(Z)-1-(1-aminoethenoxy)prop-1-en-2-amine
PubChem CID130441321
Molecular FormulaC5H10N2O
Molecular Weight114.15 g/mol
Exact Mass114.08
IUPAC Name(Z)-1-(1-aminoethenoxy)prop-1-en-2-amine
SMILESC=C(N)O/C=C(/C)N
InChIInChI=1S/C5H10N2O/c1-4(6)3-8-5(2)7/h3H,2,6-7H2,1H3/b4-3-
InChIKeyLJDKNJDVSVWBFT-ARJAWSKDSA-N
XLogP0.25
TPSA61.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.15
LogP ≤ 50.25
H-Bond Donors ≤ 52
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 (Z)-1-(1-aminoethenoxy)prop-1-en-2-amine?
The IUPAC name of (Z)-1-(1-aminoethenoxy)prop-1-en-2-amine (CID 130441321) is (Z)-1-(1-aminoethenoxy)prop-1-en-2-amine.
What is the SMILES notation for (Z)-1-(1-aminoethenoxy)prop-1-en-2-amine?
The canonical SMILES for (Z)-1-(1-aminoethenoxy)prop-1-en-2-amine is C=C(N)O/C=C(/C)N.
What is the InChIKey of (Z)-1-(1-aminoethenoxy)prop-1-en-2-amine?
The InChIKey is LJDKNJDVSVWBFT-ARJAWSKDSA-N. The full InChI is InChI=1S/C5H10N2O/c1-4(6)3-8-5(2)7/h3H,2,6-7H2,1H3/b4-3-.
What are the key properties of (Z)-1-(1-aminoethenoxy)prop-1-en-2-amine?
(Z)-1-(1-aminoethenoxy)prop-1-en-2-amine has a molecular weight of 114.15 g/mol, XLogP of 0.25, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-(1-aminoethenoxy)prop-1-en-2-amine is sourced from PubChem (CID 130441321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).