[(3-bromothiophen-2-yl)-(4-propylmorpholin-2-yl)methyl]hydrazine

C12H20BrN3OS — CID 105247967

IUPAC[(3-bromothiophen-2-yl)-(4-propylmorpholin-2-yl)methyl]hydrazine
SMILESCCCN1CCOC(C(NN)c2sccc2Br)C1
InChIInChI=1S/C12H20BrN3OS/c1-2-4-16-5-6-17-10(8-16)11(15-14)12-9(13)3-7-18-12/h3,7,10-11,15H,2,4-6,8,14H2,1H3
InChIKeyFFLGZURLRJPCNU-UHFFFAOYSA-N
MW334.28 g/mol
LogP2.13
Rot. Bonds5

About [(3-bromothiophen-2-yl)-(4-propylmorpholin-2-yl)methyl]hydrazine

[(3-bromothiophen-2-yl)-(4-propylmorpholin-2-yl)methyl]hydrazine (PubChem CID 105247967) has the molecular formula C12H20BrN3OS and a molecular weight of 334.28 g/mol. Its IUPAC name is [(3-bromothiophen-2-yl)-(4-propylmorpholin-2-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(3-bromothiophen-2-yl)-(4-propylmorpholin-2-yl)methyl]hydrazine
PubChem CID105247967
Molecular FormulaC12H20BrN3OS
Molecular Weight334.28 g/mol
Exact Mass333.05
IUPAC Name[(3-bromothiophen-2-yl)-(4-propylmorpholin-2-yl)methyl]hydrazine
SMILESCCCN1CCOC(C(NN)c2sccc2Br)C1
InChIInChI=1S/C12H20BrN3OS/c1-2-4-16-5-6-17-10(8-16)11(15-14)12-9(13)3-7-18-12/h3,7,10-11,15H,2,4-6,8,14H2,1H3
InChIKeyFFLGZURLRJPCNU-UHFFFAOYSA-N
XLogP2.13
TPSA50.52 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.28
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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

[(4-bromo-3-chloro-2-fluorophenyl)-(4-propylmorpholin-2-yl)methyl]hydrazine
CID 106765331
[(3,5-dimethylphenyl)-(4-propylmorpholin-2-yl)methyl]hydrazine
CID 105247957
1-(4-bromothiophen-3-yl)-N-methyl-1-(4-propylmorpholin-2-yl)methanamine
CID 79675911
[2-(4-bromophenyl)-1-(4-propylmorpholin-2-yl)ethyl]hydrazine
CID 105247945
[(4-propylmorpholin-2-yl)-(2,4,5-trimethylphenyl)methyl]hydrazine
CID 105247926
[(4-ethoxyphenyl)-(4-propylmorpholin-2-yl)methyl]hydrazine
CID 105247824
[(3,4-dichlorophenyl)-(4-propylmorpholin-2-yl)methyl]hydrazine
CID 105247889
1-(4-propylmorpholin-2-yl)butylhydrazine
CID 105247790
[(2,5-dichlorophenyl)-(4-propylmorpholin-2-yl)methyl]hydrazine
CID 105247885
[2-(5-bromothiophen-2-yl)-1-(4-propylmorpholin-2-yl)ethyl]hydrazine
CID 105247768
N-[(4-bromothiophen-3-yl)-(4-propylmorpholin-2-yl)methyl]propan-1-amine
CID 79676101
[(5-fluoro-2-methylphenyl)-(4-propylmorpholin-2-yl)methyl]hydrazine
CID 105247795

Frequently Asked Questions

What is the IUPAC name of [(3-bromothiophen-2-yl)-(4-propylmorpholin-2-yl)methyl]hydrazine?
The IUPAC name of [(3-bromothiophen-2-yl)-(4-propylmorpholin-2-yl)methyl]hydrazine (CID 105247967) is [(3-bromothiophen-2-yl)-(4-propylmorpholin-2-yl)methyl]hydrazine.
What is the SMILES notation for [(3-bromothiophen-2-yl)-(4-propylmorpholin-2-yl)methyl]hydrazine?
The canonical SMILES for [(3-bromothiophen-2-yl)-(4-propylmorpholin-2-yl)methyl]hydrazine is CCCN1CCOC(C(NN)c2sccc2Br)C1.
What is the InChIKey of [(3-bromothiophen-2-yl)-(4-propylmorpholin-2-yl)methyl]hydrazine?
The InChIKey is FFLGZURLRJPCNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20BrN3OS/c1-2-4-16-5-6-17-10(8-16)11(15-14)12-9(13)3-7-18-12/h3,7,10-11,15H,2,4-6,8,14H2,1H3.
What are the key properties of [(3-bromothiophen-2-yl)-(4-propylmorpholin-2-yl)methyl]hydrazine?
[(3-bromothiophen-2-yl)-(4-propylmorpholin-2-yl)methyl]hydrazine has a molecular weight of 334.28 g/mol, XLogP of 2.13, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-bromothiophen-2-yl)-(4-propylmorpholin-2-yl)methyl]hydrazine is sourced from PubChem (CID 105247967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).