[1-(3-bromothiophen-2-yl)-3-methyl-3-morpholin-4-ylpentan-2-yl]hydrazine

C14H24BrN3OS — CID 105241568

IUPAC[1-(3-bromothiophen-2-yl)-3-methyl-3-morpholin-4-ylpentan-2-yl]hydrazine
SMILESCCC(C)(C(Cc1sccc1Br)NN)N1CCOCC1
InChIInChI=1S/C14H24BrN3OS/c1-3-14(2,18-5-7-19-8-6-18)13(17-16)10-12-11(15)4-9-20-12/h4,9,13,17H,3,5-8,10,16H2,1-2H3
InChIKeyMQJNCEHDCUVCLO-UHFFFAOYSA-N
MW362.34 g/mol
LogP2.39
Rot. Bonds6

About [1-(3-bromothiophen-2-yl)-3-methyl-3-morpholin-4-ylpentan-2-yl]hydrazine

[1-(3-bromothiophen-2-yl)-3-methyl-3-morpholin-4-ylpentan-2-yl]hydrazine (PubChem CID 105241568) has the molecular formula C14H24BrN3OS and a molecular weight of 362.34 g/mol. Its IUPAC name is [1-(3-bromothiophen-2-yl)-3-methyl-3-morpholin-4-ylpentan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(3-bromothiophen-2-yl)-3-methyl-3-morpholin-4-ylpentan-2-yl]hydrazine
PubChem CID105241568
Molecular FormulaC14H24BrN3OS
Molecular Weight362.34 g/mol
Exact Mass361.08
IUPAC Name[1-(3-bromothiophen-2-yl)-3-methyl-3-morpholin-4-ylpentan-2-yl]hydrazine
SMILESCCC(C)(C(Cc1sccc1Br)NN)N1CCOCC1
InChIInChI=1S/C14H24BrN3OS/c1-3-14(2,18-5-7-19-8-6-18)13(17-16)10-12-11(15)4-9-20-12/h4,9,13,17H,3,5-8,10,16H2,1-2H3
InChIKeyMQJNCEHDCUVCLO-UHFFFAOYSA-N
XLogP2.39
TPSA50.52 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.34
LogP ≤ 52.39
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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Frequently Asked Questions

What is the IUPAC name of [1-(3-bromothiophen-2-yl)-3-methyl-3-morpholin-4-ylpentan-2-yl]hydrazine?
The IUPAC name of [1-(3-bromothiophen-2-yl)-3-methyl-3-morpholin-4-ylpentan-2-yl]hydrazine (CID 105241568) is [1-(3-bromothiophen-2-yl)-3-methyl-3-morpholin-4-ylpentan-2-yl]hydrazine.
What is the SMILES notation for [1-(3-bromothiophen-2-yl)-3-methyl-3-morpholin-4-ylpentan-2-yl]hydrazine?
The canonical SMILES for [1-(3-bromothiophen-2-yl)-3-methyl-3-morpholin-4-ylpentan-2-yl]hydrazine is CCC(C)(C(Cc1sccc1Br)NN)N1CCOCC1.
What is the InChIKey of [1-(3-bromothiophen-2-yl)-3-methyl-3-morpholin-4-ylpentan-2-yl]hydrazine?
The InChIKey is MQJNCEHDCUVCLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24BrN3OS/c1-3-14(2,18-5-7-19-8-6-18)13(17-16)10-12-11(15)4-9-20-12/h4,9,13,17H,3,5-8,10,16H2,1-2H3.
What are the key properties of [1-(3-bromothiophen-2-yl)-3-methyl-3-morpholin-4-ylpentan-2-yl]hydrazine?
[1-(3-bromothiophen-2-yl)-3-methyl-3-morpholin-4-ylpentan-2-yl]hydrazine has a molecular weight of 362.34 g/mol, XLogP of 2.39, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-bromothiophen-2-yl)-3-methyl-3-morpholin-4-ylpentan-2-yl]hydrazine is sourced from PubChem (CID 105241568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).