[1-(3-chlorothiophen-2-yl)-4-methoxy-3-methylbutyl]hydrazine

C10H17ClN2OS — CID 107362431

IUPAC[1-(3-chlorothiophen-2-yl)-4-methoxy-3-methylbutyl]hydrazine
SMILESCOCC(C)CC(NN)c1sccc1Cl
InChIInChI=1S/C10H17ClN2OS/c1-7(6-14-2)5-9(13-12)10-8(11)3-4-15-10/h3-4,7,9,13H,5-6,12H2,1-2H3
InChIKeyYEZFWJMDPAJTEH-UHFFFAOYSA-N
MW248.78 g/mol
LogP2.58
Rot. Bonds6

About [1-(3-chlorothiophen-2-yl)-4-methoxy-3-methylbutyl]hydrazine

[1-(3-chlorothiophen-2-yl)-4-methoxy-3-methylbutyl]hydrazine (PubChem CID 107362431) has the molecular formula C10H17ClN2OS and a molecular weight of 248.78 g/mol. Its IUPAC name is [1-(3-chlorothiophen-2-yl)-4-methoxy-3-methylbutyl]hydrazine.

Molecular Properties

Compound Name[1-(3-chlorothiophen-2-yl)-4-methoxy-3-methylbutyl]hydrazine
PubChem CID107362431
Molecular FormulaC10H17ClN2OS
Molecular Weight248.78 g/mol
Exact Mass248.08
IUPAC Name[1-(3-chlorothiophen-2-yl)-4-methoxy-3-methylbutyl]hydrazine
SMILESCOCC(C)CC(NN)c1sccc1Cl
InChIInChI=1S/C10H17ClN2OS/c1-7(6-14-2)5-9(13-12)10-8(11)3-4-15-10/h3-4,7,9,13H,5-6,12H2,1-2H3
InChIKeyYEZFWJMDPAJTEH-UHFFFAOYSA-N
XLogP2.58
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.78
LogP ≤ 52.58
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-methoxy-3-methylbutyl]hydrazine
CID 107362297
1-(3-chlorothiophen-2-yl)pent-3-ynylhydrazine
CID 105290579
(1R)-1-(3-chlorothiophen-2-yl)-2-methoxyethanamine
CID 130987016
[1-(3-chlorothiophen-2-yl)-3,3,3-trifluoropropyl]hydrazine
CID 107362011
1-(3-chlorothiophen-2-yl)nonylhydrazine
CID 105294361
1-(3-chlorothiophen-2-yl)-N-ethyl-3-methoxypropan-1-amine
CID 107359701
1-(3-chlorothiophen-2-yl)-N-methyl-2-propan-2-yloxyethanamine
CID 105013001
[2-(5-chloro-2-methoxyphenyl)-1-(3-chlorothiophen-2-yl)ethyl]hydrazine
CID 105297539
[(3-chlorothiophen-2-yl)-[2-(2-methoxyethoxy)phenyl]methyl]hydrazine
CID 105334131
[1-(3-chlorothiophen-2-yl)-2-(furan-2-yl)ethyl]hydrazine
CID 105331476
[1-(3-chlorothiophen-2-yl)-2-methoxy-2-phenylethyl]hydrazine
CID 107362207
[(3-chlorothiophen-2-yl)-(4-methoxyphenyl)methyl]hydrazine
CID 105286186

Frequently Asked Questions

What is the IUPAC name of [1-(3-chlorothiophen-2-yl)-4-methoxy-3-methylbutyl]hydrazine?
The IUPAC name of [1-(3-chlorothiophen-2-yl)-4-methoxy-3-methylbutyl]hydrazine (CID 107362431) is [1-(3-chlorothiophen-2-yl)-4-methoxy-3-methylbutyl]hydrazine.
What is the SMILES notation for [1-(3-chlorothiophen-2-yl)-4-methoxy-3-methylbutyl]hydrazine?
The canonical SMILES for [1-(3-chlorothiophen-2-yl)-4-methoxy-3-methylbutyl]hydrazine is COCC(C)CC(NN)c1sccc1Cl.
What is the InChIKey of [1-(3-chlorothiophen-2-yl)-4-methoxy-3-methylbutyl]hydrazine?
The InChIKey is YEZFWJMDPAJTEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17ClN2OS/c1-7(6-14-2)5-9(13-12)10-8(11)3-4-15-10/h3-4,7,9,13H,5-6,12H2,1-2H3.
What are the key properties of [1-(3-chlorothiophen-2-yl)-4-methoxy-3-methylbutyl]hydrazine?
[1-(3-chlorothiophen-2-yl)-4-methoxy-3-methylbutyl]hydrazine has a molecular weight of 248.78 g/mol, XLogP of 2.58, 6 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)-4-methoxy-3-methylbutyl]hydrazine is sourced from PubChem (CID 107362431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).