(Z)-1-[amino(ethyl)amino]prop-1-en-2-amine

C5H13N3 — CID 135258423

IUPAC(Z)-1-[amino(ethyl)amino]prop-1-en-2-amine
SMILESCCN(N)/C=C(/C)N
InChIInChI=1S/C5H13N3/c1-3-8(7)4-5(2)6/h4H,3,6-7H2,1-2H3/b5-4-
InChIKeyLIJUTBRJCROFSV-PLNGDYQASA-N
MW115.18 g/mol
LogP0.00
Rot. Bonds2

About (Z)-1-[amino(ethyl)amino]prop-1-en-2-amine

(Z)-1-[amino(ethyl)amino]prop-1-en-2-amine (PubChem CID 135258423) has the molecular formula C5H13N3 and a molecular weight of 115.18 g/mol. Its IUPAC name is (Z)-1-[amino(ethyl)amino]prop-1-en-2-amine.

Molecular Properties

Compound Name(Z)-1-[amino(ethyl)amino]prop-1-en-2-amine
PubChem CID135258423
Molecular FormulaC5H13N3
Molecular Weight115.18 g/mol
Exact Mass115.11
IUPAC Name(Z)-1-[amino(ethyl)amino]prop-1-en-2-amine
SMILESCCN(N)/C=C(/C)N
InChIInChI=1S/C5H13N3/c1-3-8(7)4-5(2)6/h4H,3,6-7H2,1-2H3/b5-4-
InChIKeyLIJUTBRJCROFSV-PLNGDYQASA-N
XLogP0.00
TPSA55.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.18
LogP ≤ 50.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z)-1-[amino(ethyl)amino]prop-1-en-2-amine?
The IUPAC name of (Z)-1-[amino(ethyl)amino]prop-1-en-2-amine (CID 135258423) is (Z)-1-[amino(ethyl)amino]prop-1-en-2-amine.
What is the SMILES notation for (Z)-1-[amino(ethyl)amino]prop-1-en-2-amine?
The canonical SMILES for (Z)-1-[amino(ethyl)amino]prop-1-en-2-amine is CCN(N)/C=C(/C)N.
What is the InChIKey of (Z)-1-[amino(ethyl)amino]prop-1-en-2-amine?
The InChIKey is LIJUTBRJCROFSV-PLNGDYQASA-N. The full InChI is InChI=1S/C5H13N3/c1-3-8(7)4-5(2)6/h4H,3,6-7H2,1-2H3/b5-4-.
What are the key properties of (Z)-1-[amino(ethyl)amino]prop-1-en-2-amine?
(Z)-1-[amino(ethyl)amino]prop-1-en-2-amine has a molecular weight of 115.18 g/mol, XLogP of 0.00, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-[amino(ethyl)amino]prop-1-en-2-amine is sourced from PubChem (CID 135258423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).