1-[(1E)-buta-1,3-dienyl]-2-ethyl-1,2-dimethylhydrazine;ethane

C10H22N2 — CID 143701320

IUPAC1-[(1E)-buta-1,3-dienyl]-2-ethyl-1,2-dimethylhydrazine;ethane
SMILESC=C/C=C/N(C)N(C)CC.CC
InChIInChI=1S/C8H16N2.C2H6/c1-5-7-8-10(4)9(3)6-2;1-2/h5,7-8H,1,6H2,2-4H3;1-2H3/b8-7+;
InChIKeyAVRGQUNAZRJTEH-USRGLUTNSA-N
MW170.30 g/mol
LogP2.51
Rot. Bonds4

About 1-[(1E)-buta-1,3-dienyl]-2-ethyl-1,2-dimethylhydrazine;ethane

1-[(1E)-buta-1,3-dienyl]-2-ethyl-1,2-dimethylhydrazine;ethane (PubChem CID 143701320) has the molecular formula C10H22N2 and a molecular weight of 170.30 g/mol. Its IUPAC name is 1-[(1E)-buta-1,3-dienyl]-2-ethyl-1,2-dimethylhydrazine;ethane.

Molecular Properties

Compound Name1-[(1E)-buta-1,3-dienyl]-2-ethyl-1,2-dimethylhydrazine;ethane
PubChem CID143701320
Molecular FormulaC10H22N2
Molecular Weight170.30 g/mol
Exact Mass170.18
IUPAC Name1-[(1E)-buta-1,3-dienyl]-2-ethyl-1,2-dimethylhydrazine;ethane
SMILESC=C/C=C/N(C)N(C)CC.CC
InChIInChI=1S/C8H16N2.C2H6/c1-5-7-8-10(4)9(3)6-2;1-2/h5,7-8H,1,6H2,2-4H3;1-2H3/b8-7+;
InChIKeyAVRGQUNAZRJTEH-USRGLUTNSA-N
XLogP2.51
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 52.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(1Z)-N,N-dimethylbuta-1,3-dien-1-amine;ethane;propane
CID 143328939
(1E)-N-methyl-N-propylbuta-1,3-dien-1-amine
CID 142943331
ethane;(3Z)-hexa-1,3,5-triene;propane
CID 142062128
N,N-diethylpenta-2,4-dien-1-amine
CID 73447905
(1E)-N-methyl-N-prop-2-enylbuta-1,3-dien-1-amine
CID 143685278
1-buta-1,3-dienyl-1-methylhydrazine
CID 91065871
(1Z,3Z)-N-[(1Z)-buta-1,3-dienyl]-N-methylhexa-1,3,5-trien-1-amine
CID 163917439
but-1-ene;ethane;(3Z)-hexa-1,3,5-triene
CID 144520758
N-[(1E)-buta-1,3-dienyl]-N-methylformamide
CID 58812160
ethane;penta-1,3-diene;propane
CID 143367111
ethane;N-ethenyl-N-methylethanamine
CID 176944347
ethane;ethene;(3E)-hexa-1,3,5-triene
CID 91058254

Frequently Asked Questions

What is the IUPAC name of 1-[(1E)-buta-1,3-dienyl]-2-ethyl-1,2-dimethylhydrazine;ethane?
The IUPAC name of 1-[(1E)-buta-1,3-dienyl]-2-ethyl-1,2-dimethylhydrazine;ethane (CID 143701320) is 1-[(1E)-buta-1,3-dienyl]-2-ethyl-1,2-dimethylhydrazine;ethane.
What is the SMILES notation for 1-[(1E)-buta-1,3-dienyl]-2-ethyl-1,2-dimethylhydrazine;ethane?
The canonical SMILES for 1-[(1E)-buta-1,3-dienyl]-2-ethyl-1,2-dimethylhydrazine;ethane is C=C/C=C/N(C)N(C)CC.CC.
What is the InChIKey of 1-[(1E)-buta-1,3-dienyl]-2-ethyl-1,2-dimethylhydrazine;ethane?
The InChIKey is AVRGQUNAZRJTEH-USRGLUTNSA-N. The full InChI is InChI=1S/C8H16N2.C2H6/c1-5-7-8-10(4)9(3)6-2;1-2/h5,7-8H,1,6H2,2-4H3;1-2H3/b8-7+;.
What are the key properties of 1-[(1E)-buta-1,3-dienyl]-2-ethyl-1,2-dimethylhydrazine;ethane?
1-[(1E)-buta-1,3-dienyl]-2-ethyl-1,2-dimethylhydrazine;ethane has a molecular weight of 170.30 g/mol, XLogP of 2.51, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1E)-buta-1,3-dienyl]-2-ethyl-1,2-dimethylhydrazine;ethane is sourced from PubChem (CID 143701320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).