ethene;1-[(Z)-3-ethenylpent-3-enyl]piperidine-4-carbohydrazide

C15H27N3O — CID 177025444

IUPACethene;1-[(Z)-3-ethenylpent-3-enyl]piperidine-4-carbohydrazide
SMILESC=C.C=C/C(=C\C)CCN1CCC(C(=O)NN)CC1
InChIInChI=1S/C13H23N3O.C2H4/c1-3-11(4-2)5-8-16-9-6-12(7-10-16)13(17)15-14;1-2/h3-4,12H,1,5-10,14H2,2H3,(H,15,17);1-2H2/b11-4+;
InChIKeyUTTMFVUMUNULKG-SODSUQDMSA-N
MW265.40 g/mol
LogP2.01
Rot. Bonds5

About ethene;1-[(Z)-3-ethenylpent-3-enyl]piperidine-4-carbohydrazide

ethene;1-[(Z)-3-ethenylpent-3-enyl]piperidine-4-carbohydrazide (PubChem CID 177025444) has the molecular formula C15H27N3O and a molecular weight of 265.40 g/mol. Its IUPAC name is ethene;1-[(Z)-3-ethenylpent-3-enyl]piperidine-4-carbohydrazide.

Molecular Properties

Compound Nameethene;1-[(Z)-3-ethenylpent-3-enyl]piperidine-4-carbohydrazide
PubChem CID177025444
Molecular FormulaC15H27N3O
Molecular Weight265.40 g/mol
Exact Mass265.22
IUPAC Nameethene;1-[(Z)-3-ethenylpent-3-enyl]piperidine-4-carbohydrazide
SMILESC=C.C=C/C(=C\C)CCN1CCC(C(=O)NN)CC1
InChIInChI=1S/C13H23N3O.C2H4/c1-3-11(4-2)5-8-16-9-6-12(7-10-16)13(17)15-14;1-2/h3-4,12H,1,5-10,14H2,2H3,(H,15,17);1-2H2/b11-4+;
InChIKeyUTTMFVUMUNULKG-SODSUQDMSA-N
XLogP2.01
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of ethene;1-[(Z)-3-ethenylpent-3-enyl]piperidine-4-carbohydrazide?
The IUPAC name of ethene;1-[(Z)-3-ethenylpent-3-enyl]piperidine-4-carbohydrazide (CID 177025444) is ethene;1-[(Z)-3-ethenylpent-3-enyl]piperidine-4-carbohydrazide.
What is the SMILES notation for ethene;1-[(Z)-3-ethenylpent-3-enyl]piperidine-4-carbohydrazide?
The canonical SMILES for ethene;1-[(Z)-3-ethenylpent-3-enyl]piperidine-4-carbohydrazide is C=C.C=C/C(=C\C)CCN1CCC(C(=O)NN)CC1.
What is the InChIKey of ethene;1-[(Z)-3-ethenylpent-3-enyl]piperidine-4-carbohydrazide?
The InChIKey is UTTMFVUMUNULKG-SODSUQDMSA-N. The full InChI is InChI=1S/C13H23N3O.C2H4/c1-3-11(4-2)5-8-16-9-6-12(7-10-16)13(17)15-14;1-2/h3-4,12H,1,5-10,14H2,2H3,(H,15,17);1-2H2/b11-4+;.
What are the key properties of ethene;1-[(Z)-3-ethenylpent-3-enyl]piperidine-4-carbohydrazide?
ethene;1-[(Z)-3-ethenylpent-3-enyl]piperidine-4-carbohydrazide has a molecular weight of 265.40 g/mol, XLogP of 2.01, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethene;1-[(Z)-3-ethenylpent-3-enyl]piperidine-4-carbohydrazide is sourced from PubChem (CID 177025444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).