4-(3-bromothiophen-2-yl)-3-hydrazinyl-N,N,2-trimethylbutan-2-amine

C11H20BrN3S — CID 105239061

IUPAC4-(3-bromothiophen-2-yl)-3-hydrazinyl-N,N,2-trimethylbutan-2-amine
SMILESCN(C)C(C)(C)C(Cc1sccc1Br)NN
InChIInChI=1S/C11H20BrN3S/c1-11(2,15(3)4)10(14-13)7-9-8(12)5-6-16-9/h5-6,10,14H,7,13H2,1-4H3
InChIKeyCFPDYKYJSMRDNU-UHFFFAOYSA-N
MW306.27 g/mol
LogP2.23
Rot. Bonds5

About 4-(3-bromothiophen-2-yl)-3-hydrazinyl-N,N,2-trimethylbutan-2-amine

4-(3-bromothiophen-2-yl)-3-hydrazinyl-N,N,2-trimethylbutan-2-amine (PubChem CID 105239061) has the molecular formula C11H20BrN3S and a molecular weight of 306.27 g/mol. Its IUPAC name is 4-(3-bromothiophen-2-yl)-3-hydrazinyl-N,N,2-trimethylbutan-2-amine.

Molecular Properties

Compound Name4-(3-bromothiophen-2-yl)-3-hydrazinyl-N,N,2-trimethylbutan-2-amine
PubChem CID105239061
Molecular FormulaC11H20BrN3S
Molecular Weight306.27 g/mol
Exact Mass305.06
IUPAC Name4-(3-bromothiophen-2-yl)-3-hydrazinyl-N,N,2-trimethylbutan-2-amine
SMILESCN(C)C(C)(C)C(Cc1sccc1Br)NN
InChIInChI=1S/C11H20BrN3S/c1-11(2,15(3)4)10(14-13)7-9-8(12)5-6-16-9/h5-6,10,14H,7,13H2,1-4H3
InChIKeyCFPDYKYJSMRDNU-UHFFFAOYSA-N
XLogP2.23
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.27
LogP ≤ 52.23
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)-3-methoxy-3-methylpentan-2-yl]hydrazine
CID 105274525
[1-(3-bromothiophen-2-yl)-3-ethoxy-3-ethylpentan-2-yl]hydrazine
CID 105275170
3-(3-bromothiophen-2-yl)-2-hydrazinyl-N,N-dimethylpropan-1-amine
CID 105244859
1-(3-bromothiophen-2-yl)-1-hydrazinyl-N,N,2-trimethylpropan-2-amine
CID 105239110
4-(3-bromothiophen-2-yl)-3-hydrazinyl-N,N-dimethylbutan-1-amine
CID 105259328
[1-(3-bromothiophen-2-yl)-3-methyl-3-morpholin-4-ylpentan-2-yl]hydrazine
CID 105241568
1-(3-bromothiophen-2-yl)-N-ethyl-3-methoxy-3-methylpentan-2-amine
CID 116757961
1,2-bis(3-bromothiophen-2-yl)ethylhydrazine
CID 105299585
[1-(7-bicyclo[4.1.0]heptanyl)-2-(3-bromothiophen-2-yl)ethyl]hydrazine
CID 105299591
3-(3-bromothiophen-2-yl)-N-tert-butyl-2-methylpropan-1-amine
CID 62528495
1-(3-bromothiophen-2-yl)-3-tert-butylsulfanylpropan-2-amine
CID 65132986
2-[(3-bromothiophen-2-yl)methyl]-N,3,3-trimethylbutan-1-amine
CID 83138413

Frequently Asked Questions

What is the IUPAC name of 4-(3-bromothiophen-2-yl)-3-hydrazinyl-N,N,2-trimethylbutan-2-amine?
The IUPAC name of 4-(3-bromothiophen-2-yl)-3-hydrazinyl-N,N,2-trimethylbutan-2-amine (CID 105239061) is 4-(3-bromothiophen-2-yl)-3-hydrazinyl-N,N,2-trimethylbutan-2-amine.
What is the SMILES notation for 4-(3-bromothiophen-2-yl)-3-hydrazinyl-N,N,2-trimethylbutan-2-amine?
The canonical SMILES for 4-(3-bromothiophen-2-yl)-3-hydrazinyl-N,N,2-trimethylbutan-2-amine is CN(C)C(C)(C)C(Cc1sccc1Br)NN.
What is the InChIKey of 4-(3-bromothiophen-2-yl)-3-hydrazinyl-N,N,2-trimethylbutan-2-amine?
The InChIKey is CFPDYKYJSMRDNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20BrN3S/c1-11(2,15(3)4)10(14-13)7-9-8(12)5-6-16-9/h5-6,10,14H,7,13H2,1-4H3.
What are the key properties of 4-(3-bromothiophen-2-yl)-3-hydrazinyl-N,N,2-trimethylbutan-2-amine?
4-(3-bromothiophen-2-yl)-3-hydrazinyl-N,N,2-trimethylbutan-2-amine has a molecular weight of 306.27 g/mol, XLogP of 2.23, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-bromothiophen-2-yl)-3-hydrazinyl-N,N,2-trimethylbutan-2-amine is sourced from PubChem (CID 105239061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).