(Z)-3-[(1E,4Z)-cycloocta-1,4-dien-1-yl]-3-hydrazinylprop-2-en-1-amine

C11H19N3 — CID 138631013

IUPAC(Z)-3-[(1E,4Z)-cycloocta-1,4-dien-1-yl]-3-hydrazinylprop-2-en-1-amine
SMILESNC/C=C(NN)/C1=C/C/C=C\CCC1
InChIInChI=1S/C11H19N3/c12-9-8-11(14-13)10-6-4-2-1-3-5-7-10/h1-2,6,8,14H,3-5,7,9,12-13H2/b2-1-,10-6+,11-8-
InChIKeyCYYQIDCJKQGHAV-KMZIUMRMSA-N
MW193.29 g/mol
LogP1.35
Rot. Bonds3

About (Z)-3-[(1E,4Z)-cycloocta-1,4-dien-1-yl]-3-hydrazinylprop-2-en-1-amine

(Z)-3-[(1E,4Z)-cycloocta-1,4-dien-1-yl]-3-hydrazinylprop-2-en-1-amine (PubChem CID 138631013) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is (Z)-3-[(1E,4Z)-cycloocta-1,4-dien-1-yl]-3-hydrazinylprop-2-en-1-amine.

Molecular Properties

Compound Name(Z)-3-[(1E,4Z)-cycloocta-1,4-dien-1-yl]-3-hydrazinylprop-2-en-1-amine
PubChem CID138631013
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC Name(Z)-3-[(1E,4Z)-cycloocta-1,4-dien-1-yl]-3-hydrazinylprop-2-en-1-amine
SMILESNC/C=C(NN)/C1=C/C/C=C\CCC1
InChIInChI=1S/C11H19N3/c12-9-8-11(14-13)10-6-4-2-1-3-5-7-10/h1-2,6,8,14H,3-5,7,9,12-13H2/b2-1-,10-6+,11-8-
InChIKeyCYYQIDCJKQGHAV-KMZIUMRMSA-N
XLogP1.35
TPSA64.07 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 51.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', '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)-3-[(1E,4Z)-cycloocta-1,4-dien-1-yl]-3-hydrazinylprop-2-en-1-amine?
The IUPAC name of (Z)-3-[(1E,4Z)-cycloocta-1,4-dien-1-yl]-3-hydrazinylprop-2-en-1-amine (CID 138631013) is (Z)-3-[(1E,4Z)-cycloocta-1,4-dien-1-yl]-3-hydrazinylprop-2-en-1-amine.
What is the SMILES notation for (Z)-3-[(1E,4Z)-cycloocta-1,4-dien-1-yl]-3-hydrazinylprop-2-en-1-amine?
The canonical SMILES for (Z)-3-[(1E,4Z)-cycloocta-1,4-dien-1-yl]-3-hydrazinylprop-2-en-1-amine is NC/C=C(NN)/C1=C/C/C=C\CCC1.
What is the InChIKey of (Z)-3-[(1E,4Z)-cycloocta-1,4-dien-1-yl]-3-hydrazinylprop-2-en-1-amine?
The InChIKey is CYYQIDCJKQGHAV-KMZIUMRMSA-N. The full InChI is InChI=1S/C11H19N3/c12-9-8-11(14-13)10-6-4-2-1-3-5-7-10/h1-2,6,8,14H,3-5,7,9,12-13H2/b2-1-,10-6+,11-8-.
What are the key properties of (Z)-3-[(1E,4Z)-cycloocta-1,4-dien-1-yl]-3-hydrazinylprop-2-en-1-amine?
(Z)-3-[(1E,4Z)-cycloocta-1,4-dien-1-yl]-3-hydrazinylprop-2-en-1-amine has a molecular weight of 193.29 g/mol, XLogP of 1.35, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-[(1E,4Z)-cycloocta-1,4-dien-1-yl]-3-hydrazinylprop-2-en-1-amine is sourced from PubChem (CID 138631013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).