[1-(3-chlorothiophen-2-yl)-3-methoxy-3-methylbutyl]hydrazine

C10H17ClN2OS — CID 107362297

IUPAC[1-(3-chlorothiophen-2-yl)-3-methoxy-3-methylbutyl]hydrazine
SMILESCOC(C)(C)CC(NN)c1sccc1Cl
InChIInChI=1S/C10H17ClN2OS/c1-10(2,14-3)6-8(13-12)9-7(11)4-5-15-9/h4-5,8,13H,6,12H2,1-3H3
InChIKeyDYJKGUCSCZGNEZ-UHFFFAOYSA-N
MW248.78 g/mol
LogP2.72
Rot. Bonds5

About [1-(3-chlorothiophen-2-yl)-3-methoxy-3-methylbutyl]hydrazine

[1-(3-chlorothiophen-2-yl)-3-methoxy-3-methylbutyl]hydrazine (PubChem CID 107362297) has the molecular formula C10H17ClN2OS and a molecular weight of 248.78 g/mol. Its IUPAC name is [1-(3-chlorothiophen-2-yl)-3-methoxy-3-methylbutyl]hydrazine.

Molecular Properties

Compound Name[1-(3-chlorothiophen-2-yl)-3-methoxy-3-methylbutyl]hydrazine
PubChem CID107362297
Molecular FormulaC10H17ClN2OS
Molecular Weight248.78 g/mol
Exact Mass248.08
IUPAC Name[1-(3-chlorothiophen-2-yl)-3-methoxy-3-methylbutyl]hydrazine
SMILESCOC(C)(C)CC(NN)c1sccc1Cl
InChIInChI=1S/C10H17ClN2OS/c1-10(2,14-3)6-8(13-12)9-7(11)4-5-15-9/h4-5,8,13H,6,12H2,1-3H3
InChIKeyDYJKGUCSCZGNEZ-UHFFFAOYSA-N
XLogP2.72
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.78
LogP ≤ 52.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

[1-(3-chlorothiophen-2-yl)-3,3,3-trifluoropropyl]hydrazine
CID 107362011
[1-(3-chlorothiophen-2-yl)-4-methoxy-3-methylbutyl]hydrazine
CID 107362431
1-(3-chlorothiophen-2-yl)nonylhydrazine
CID 105294361
1-(3-chlorothiophen-2-yl)pent-3-ynylhydrazine
CID 105290579
[2-(5-chloro-2-methoxyphenyl)-1-(3-chlorothiophen-2-yl)ethyl]hydrazine
CID 105297539
1-(3-chlorothiophen-2-yl)-N-methyl-2-[(2-methylpropan-2-yl)oxy]ethanamine
CID 107361690
1-(3-chlorothiophen-2-yl)-3,3-difluorobutan-1-ol
CID 131081703
(3-methoxy-3-methyl-1-phenylbutyl)hydrazine
CID 103025167
1-(3-bromothiophen-2-yl)-N-ethyl-3-methoxy-3-methylbutan-1-amine
CID 103028722
[1-(3-chlorothiophen-2-yl)-2-(furan-2-yl)ethyl]hydrazine
CID 105331476
[(3-chlorothiophen-2-yl)-(4-methoxyphenyl)methyl]hydrazine
CID 105286186
1-(3-chlorothiophen-2-yl)-N,3,4,4-tetramethylpentan-1-amine
CID 80529216

Frequently Asked Questions

What is the IUPAC name of [1-(3-chlorothiophen-2-yl)-3-methoxy-3-methylbutyl]hydrazine?
The IUPAC name of [1-(3-chlorothiophen-2-yl)-3-methoxy-3-methylbutyl]hydrazine (CID 107362297) is [1-(3-chlorothiophen-2-yl)-3-methoxy-3-methylbutyl]hydrazine.
What is the SMILES notation for [1-(3-chlorothiophen-2-yl)-3-methoxy-3-methylbutyl]hydrazine?
The canonical SMILES for [1-(3-chlorothiophen-2-yl)-3-methoxy-3-methylbutyl]hydrazine is COC(C)(C)CC(NN)c1sccc1Cl.
What is the InChIKey of [1-(3-chlorothiophen-2-yl)-3-methoxy-3-methylbutyl]hydrazine?
The InChIKey is DYJKGUCSCZGNEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17ClN2OS/c1-10(2,14-3)6-8(13-12)9-7(11)4-5-15-9/h4-5,8,13H,6,12H2,1-3H3.
What are the key properties of [1-(3-chlorothiophen-2-yl)-3-methoxy-3-methylbutyl]hydrazine?
[1-(3-chlorothiophen-2-yl)-3-methoxy-3-methylbutyl]hydrazine has a molecular weight of 248.78 g/mol, XLogP of 2.72, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-chlorothiophen-2-yl)-3-methoxy-3-methylbutyl]hydrazine is sourced from PubChem (CID 107362297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).