[1-(3-bromothiophen-2-yl)-3-methoxy-3-methylpentan-2-yl]hydrazine

C11H19BrN2OS — CID 105274525

IUPAC[1-(3-bromothiophen-2-yl)-3-methoxy-3-methylpentan-2-yl]hydrazine
SMILESCCC(C)(OC)C(Cc1sccc1Br)NN
InChIInChI=1S/C11H19BrN2OS/c1-4-11(2,15-3)10(14-13)7-9-8(12)5-6-16-9/h5-6,10,14H,4,7,13H2,1-3H3
InChIKeyPCAOBBOTKWNKRH-UHFFFAOYSA-N
MW307.26 g/mol
LogP2.70
Rot. Bonds6

About [1-(3-bromothiophen-2-yl)-3-methoxy-3-methylpentan-2-yl]hydrazine

[1-(3-bromothiophen-2-yl)-3-methoxy-3-methylpentan-2-yl]hydrazine (PubChem CID 105274525) has the molecular formula C11H19BrN2OS and a molecular weight of 307.26 g/mol. Its IUPAC name is [1-(3-bromothiophen-2-yl)-3-methoxy-3-methylpentan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(3-bromothiophen-2-yl)-3-methoxy-3-methylpentan-2-yl]hydrazine
PubChem CID105274525
Molecular FormulaC11H19BrN2OS
Molecular Weight307.26 g/mol
Exact Mass306.04
IUPAC Name[1-(3-bromothiophen-2-yl)-3-methoxy-3-methylpentan-2-yl]hydrazine
SMILESCCC(C)(OC)C(Cc1sccc1Br)NN
InChIInChI=1S/C11H19BrN2OS/c1-4-11(2,15-3)10(14-13)7-9-8(12)5-6-16-9/h5-6,10,14H,4,7,13H2,1-3H3
InChIKeyPCAOBBOTKWNKRH-UHFFFAOYSA-N
XLogP2.70
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.26
LogP ≤ 52.70
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-bromothiophen-2-yl)-N-ethyl-3-methoxy-3-methylpentan-2-amine
CID 116757961
[1-(3-bromothiophen-2-yl)-3-ethoxy-3-ethylpentan-2-yl]hydrazine
CID 105275170
4-(3-bromothiophen-2-yl)-3-hydrazinyl-N,N,2-trimethylbutan-2-amine
CID 105239061
[1-(3-bromothiophen-2-yl)-3-methyl-3-morpholin-4-ylpentan-2-yl]hydrazine
CID 105241568
[1-(4-fluorophenyl)-3-methoxy-3-methylpentan-2-yl]hydrazine
CID 105274321
1-(3-bromothiophen-2-yl)-3-methoxy-3-methylbutan-2-ol
CID 79197988
1-(3-bromothiophen-2-yl)-N-ethyl-2-methoxy-2-methylbutan-1-amine
CID 116757917
[1-(4-bromo-2-chlorophenyl)-3-methoxy-3-methylpentan-2-yl]hydrazine
CID 105274474
[1-(furan-3-yl)-3-methoxy-3-methylpentan-2-yl]hydrazine
CID 105274402
[1-(3-bromothiophen-2-yl)-4-ethoxybutan-2-yl]hydrazine
CID 105299615
[1-(3-bromothiophen-2-yl)-3-propoxypropan-2-yl]hydrazine
CID 105210102
[1-(3-bromothiophen-2-yl)-5-methoxyhexan-2-yl]hydrazine
CID 105299566

Frequently Asked Questions

What is the IUPAC name of [1-(3-bromothiophen-2-yl)-3-methoxy-3-methylpentan-2-yl]hydrazine?
The IUPAC name of [1-(3-bromothiophen-2-yl)-3-methoxy-3-methylpentan-2-yl]hydrazine (CID 105274525) is [1-(3-bromothiophen-2-yl)-3-methoxy-3-methylpentan-2-yl]hydrazine.
What is the SMILES notation for [1-(3-bromothiophen-2-yl)-3-methoxy-3-methylpentan-2-yl]hydrazine?
The canonical SMILES for [1-(3-bromothiophen-2-yl)-3-methoxy-3-methylpentan-2-yl]hydrazine is CCC(C)(OC)C(Cc1sccc1Br)NN.
What is the InChIKey of [1-(3-bromothiophen-2-yl)-3-methoxy-3-methylpentan-2-yl]hydrazine?
The InChIKey is PCAOBBOTKWNKRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19BrN2OS/c1-4-11(2,15-3)10(14-13)7-9-8(12)5-6-16-9/h5-6,10,14H,4,7,13H2,1-3H3.
What are the key properties of [1-(3-bromothiophen-2-yl)-3-methoxy-3-methylpentan-2-yl]hydrazine?
[1-(3-bromothiophen-2-yl)-3-methoxy-3-methylpentan-2-yl]hydrazine has a molecular weight of 307.26 g/mol, XLogP of 2.70, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-bromothiophen-2-yl)-3-methoxy-3-methylpentan-2-yl]hydrazine is sourced from PubChem (CID 105274525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).