(2Z)-1-(2-ethenylhydrazinyl)-N-ethyl-N-propylpenta-2,4-dien-2-amine

C12H23N3 — CID 165035925

IUPAC(2Z)-1-(2-ethenylhydrazinyl)-N-ethyl-N-propylpenta-2,4-dien-2-amine
SMILESC=C/C=C(/CNNC=C)N(CC)CCC
InChIInChI=1S/C12H23N3/c1-5-9-12(11-14-13-7-3)15(8-4)10-6-2/h5,7,9,13-14H,1,3,6,8,10-11H2,2,4H3/b12-9-
InChIKeyNJLOQVUJXAMFEH-XFXZXTDPSA-N
MW209.34 g/mol
LogP2.03
Rot. Bonds9

About (2Z)-1-(2-ethenylhydrazinyl)-N-ethyl-N-propylpenta-2,4-dien-2-amine

(2Z)-1-(2-ethenylhydrazinyl)-N-ethyl-N-propylpenta-2,4-dien-2-amine (PubChem CID 165035925) has the molecular formula C12H23N3 and a molecular weight of 209.34 g/mol. Its IUPAC name is (2Z)-1-(2-ethenylhydrazinyl)-N-ethyl-N-propylpenta-2,4-dien-2-amine.

Molecular Properties

Compound Name(2Z)-1-(2-ethenylhydrazinyl)-N-ethyl-N-propylpenta-2,4-dien-2-amine
PubChem CID165035925
Molecular FormulaC12H23N3
Molecular Weight209.34 g/mol
Exact Mass209.19
IUPAC Name(2Z)-1-(2-ethenylhydrazinyl)-N-ethyl-N-propylpenta-2,4-dien-2-amine
SMILESC=C/C=C(/CNNC=C)N(CC)CCC
InChIInChI=1S/C12H23N3/c1-5-9-12(11-14-13-7-3)15(8-4)10-6-2/h5,7,9,13-14H,1,3,6,8,10-11H2,2,4H3/b12-9-
InChIKeyNJLOQVUJXAMFEH-XFXZXTDPSA-N
XLogP2.03
TPSA27.30 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.34
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', '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 (2Z)-1-(2-ethenylhydrazinyl)-N-ethyl-N-propylpenta-2,4-dien-2-amine?
The IUPAC name of (2Z)-1-(2-ethenylhydrazinyl)-N-ethyl-N-propylpenta-2,4-dien-2-amine (CID 165035925) is (2Z)-1-(2-ethenylhydrazinyl)-N-ethyl-N-propylpenta-2,4-dien-2-amine.
What is the SMILES notation for (2Z)-1-(2-ethenylhydrazinyl)-N-ethyl-N-propylpenta-2,4-dien-2-amine?
The canonical SMILES for (2Z)-1-(2-ethenylhydrazinyl)-N-ethyl-N-propylpenta-2,4-dien-2-amine is C=C/C=C(/CNNC=C)N(CC)CCC.
What is the InChIKey of (2Z)-1-(2-ethenylhydrazinyl)-N-ethyl-N-propylpenta-2,4-dien-2-amine?
The InChIKey is NJLOQVUJXAMFEH-XFXZXTDPSA-N. The full InChI is InChI=1S/C12H23N3/c1-5-9-12(11-14-13-7-3)15(8-4)10-6-2/h5,7,9,13-14H,1,3,6,8,10-11H2,2,4H3/b12-9-.
What are the key properties of (2Z)-1-(2-ethenylhydrazinyl)-N-ethyl-N-propylpenta-2,4-dien-2-amine?
(2Z)-1-(2-ethenylhydrazinyl)-N-ethyl-N-propylpenta-2,4-dien-2-amine has a molecular weight of 209.34 g/mol, XLogP of 2.03, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-1-(2-ethenylhydrazinyl)-N-ethyl-N-propylpenta-2,4-dien-2-amine is sourced from PubChem (CID 165035925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).