[1-(5-ethylthiophen-2-yl)-4-propoxybutan-2-yl]hydrazine

C13H24N2OS — CID 105296397

IUPAC[1-(5-ethylthiophen-2-yl)-4-propoxybutan-2-yl]hydrazine
SMILESCCCOCCC(Cc1ccc(CC)s1)NN
InChIInChI=1S/C13H24N2OS/c1-3-8-16-9-7-11(15-14)10-13-6-5-12(4-2)17-13/h5-6,11,15H,3-4,7-10,14H2,1-2H3
InChIKeyAJGMAUQYVQTYOU-UHFFFAOYSA-N
MW256.41 g/mol
LogP2.50
Rot. Bonds9

About [1-(5-ethylthiophen-2-yl)-4-propoxybutan-2-yl]hydrazine

[1-(5-ethylthiophen-2-yl)-4-propoxybutan-2-yl]hydrazine (PubChem CID 105296397) has the molecular formula C13H24N2OS and a molecular weight of 256.41 g/mol. Its IUPAC name is [1-(5-ethylthiophen-2-yl)-4-propoxybutan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(5-ethylthiophen-2-yl)-4-propoxybutan-2-yl]hydrazine
PubChem CID105296397
Molecular FormulaC13H24N2OS
Molecular Weight256.41 g/mol
Exact Mass256.16
IUPAC Name[1-(5-ethylthiophen-2-yl)-4-propoxybutan-2-yl]hydrazine
SMILESCCCOCCC(Cc1ccc(CC)s1)NN
InChIInChI=1S/C13H24N2OS/c1-3-8-16-9-7-11(15-14)10-13-6-5-12(4-2)17-13/h5-6,11,15H,3-4,7-10,14H2,1-2H3
InChIKeyAJGMAUQYVQTYOU-UHFFFAOYSA-N
XLogP2.50
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.41
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-(5-ethylthiophen-2-yl)hexan-2-ylhydrazine
CID 105245716
1-(5-ethylthiophen-2-yl)decan-2-ylhydrazine
CID 105296454
1-(5-ethylthiophen-2-yl)-4-propoxybutan-2-ol
CID 105087659
[1-(5-ethylthiophen-2-yl)-5,5,5-trifluoropentan-2-yl]hydrazine
CID 105249000
N-ethyl-1-(5-ethylthiophen-2-yl)-3-propoxypropan-2-amine
CID 55094003
[1-(4-chlorophenyl)-4-propoxybutan-2-yl]hydrazine
CID 105283291
4-(2,2-difluoroethoxy)-1-(5-ethylthiophen-2-yl)-N-methylbutan-2-amine
CID 103149430
[1-(2,6-dichlorophenyl)-4-propoxybutan-2-yl]hydrazine
CID 105293129
(1-phenyl-5-propoxypentan-3-yl)hydrazine
CID 105285874
N-ethyl-1-(5-ethylthiophen-2-yl)-4-methoxybutan-2-amine
CID 62602949
[4-propoxy-1-(1,3-thiazol-2-yl)butan-2-yl]hydrazine
CID 105324590
[1-(5-ethyl-2-pyridinyl)-4-propoxybutan-2-yl]hydrazine
CID 105324383

Frequently Asked Questions

What is the IUPAC name of [1-(5-ethylthiophen-2-yl)-4-propoxybutan-2-yl]hydrazine?
The IUPAC name of [1-(5-ethylthiophen-2-yl)-4-propoxybutan-2-yl]hydrazine (CID 105296397) is [1-(5-ethylthiophen-2-yl)-4-propoxybutan-2-yl]hydrazine.
What is the SMILES notation for [1-(5-ethylthiophen-2-yl)-4-propoxybutan-2-yl]hydrazine?
The canonical SMILES for [1-(5-ethylthiophen-2-yl)-4-propoxybutan-2-yl]hydrazine is CCCOCCC(Cc1ccc(CC)s1)NN.
What is the InChIKey of [1-(5-ethylthiophen-2-yl)-4-propoxybutan-2-yl]hydrazine?
The InChIKey is AJGMAUQYVQTYOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2OS/c1-3-8-16-9-7-11(15-14)10-13-6-5-12(4-2)17-13/h5-6,11,15H,3-4,7-10,14H2,1-2H3.
What are the key properties of [1-(5-ethylthiophen-2-yl)-4-propoxybutan-2-yl]hydrazine?
[1-(5-ethylthiophen-2-yl)-4-propoxybutan-2-yl]hydrazine has a molecular weight of 256.41 g/mol, XLogP of 2.50, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(5-ethylthiophen-2-yl)-4-propoxybutan-2-yl]hydrazine is sourced from PubChem (CID 105296397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).