[3-(5-bromothiophen-2-yl)-1-cyclopropyl-1-ethoxypropan-2-yl]hydrazine

C12H19BrN2OS — CID 105272973

IUPAC[3-(5-bromothiophen-2-yl)-1-cyclopropyl-1-ethoxypropan-2-yl]hydrazine
SMILESCCOC(C1CC1)C(Cc1ccc(Br)s1)NN
InChIInChI=1S/C12H19BrN2OS/c1-2-16-12(8-3-4-8)10(15-14)7-9-5-6-11(13)17-9/h5-6,8,10,12,15H,2-4,7,14H2,1H3
InChIKeyIGMBFUCHFTYSJF-UHFFFAOYSA-N
MW319.27 g/mol
LogP2.70
Rot. Bonds7

About [3-(5-bromothiophen-2-yl)-1-cyclopropyl-1-ethoxypropan-2-yl]hydrazine

[3-(5-bromothiophen-2-yl)-1-cyclopropyl-1-ethoxypropan-2-yl]hydrazine (PubChem CID 105272973) has the molecular formula C12H19BrN2OS and a molecular weight of 319.27 g/mol. Its IUPAC name is [3-(5-bromothiophen-2-yl)-1-cyclopropyl-1-ethoxypropan-2-yl]hydrazine.

Molecular Properties

Compound Name[3-(5-bromothiophen-2-yl)-1-cyclopropyl-1-ethoxypropan-2-yl]hydrazine
PubChem CID105272973
Molecular FormulaC12H19BrN2OS
Molecular Weight319.27 g/mol
Exact Mass318.04
IUPAC Name[3-(5-bromothiophen-2-yl)-1-cyclopropyl-1-ethoxypropan-2-yl]hydrazine
SMILESCCOC(C1CC1)C(Cc1ccc(Br)s1)NN
InChIInChI=1S/C12H19BrN2OS/c1-2-16-12(8-3-4-8)10(15-14)7-9-5-6-11(13)17-9/h5-6,8,10,12,15H,2-4,7,14H2,1H3
InChIKeyIGMBFUCHFTYSJF-UHFFFAOYSA-N
XLogP2.70
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.27
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

[2-(5-bromothiophen-2-yl)-1-cyclopropylethyl]hydrazine
CID 105202339
[1-(5-bromothiophen-2-yl)-3-ethylpentan-2-yl]hydrazine
CID 105295618
(1-cyclopropyl-1-ethoxy-3-naphthalen-1-ylpropan-2-yl)hydrazine
CID 105273185
[1-cyclopropyl-1-ethoxy-3-(4-propan-2-ylphenyl)propan-2-yl]hydrazine
CID 105272958
[1-cyclopropyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)-1-ethoxypropan-2-yl]hydrazine
CID 105272985
3-(5-bromothiophen-2-yl)-1-cyclohexyl-N-ethyl-1-methoxypropan-2-amine
CID 116771653
[1-cyclopropyl-3-(3,5-difluorophenyl)-1-ethoxypropan-2-yl]hydrazine
CID 105413016
(1-cyclopropyl-1-ethoxy-4-thiophen-2-ylbutan-2-yl)hydrazine
CID 105273036
[2-(5-bromothiophen-2-yl)-1-(3-ethylcyclopentyl)ethyl]hydrazine
CID 105233392
[3-cyclopropyl-1-(5-ethylthiophen-2-yl)butan-2-yl]hydrazine
CID 105296365
[3-(4-chlorophenyl)-1-cyclohexyl-1-ethoxypropan-2-yl]hydrazine
CID 105278948
[1-(5-bromothiophen-2-yl)-3-cycloheptylpropan-2-yl]hydrazine
CID 105295656

Frequently Asked Questions

What is the IUPAC name of [3-(5-bromothiophen-2-yl)-1-cyclopropyl-1-ethoxypropan-2-yl]hydrazine?
The IUPAC name of [3-(5-bromothiophen-2-yl)-1-cyclopropyl-1-ethoxypropan-2-yl]hydrazine (CID 105272973) is [3-(5-bromothiophen-2-yl)-1-cyclopropyl-1-ethoxypropan-2-yl]hydrazine.
What is the SMILES notation for [3-(5-bromothiophen-2-yl)-1-cyclopropyl-1-ethoxypropan-2-yl]hydrazine?
The canonical SMILES for [3-(5-bromothiophen-2-yl)-1-cyclopropyl-1-ethoxypropan-2-yl]hydrazine is CCOC(C1CC1)C(Cc1ccc(Br)s1)NN.
What is the InChIKey of [3-(5-bromothiophen-2-yl)-1-cyclopropyl-1-ethoxypropan-2-yl]hydrazine?
The InChIKey is IGMBFUCHFTYSJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19BrN2OS/c1-2-16-12(8-3-4-8)10(15-14)7-9-5-6-11(13)17-9/h5-6,8,10,12,15H,2-4,7,14H2,1H3.
What are the key properties of [3-(5-bromothiophen-2-yl)-1-cyclopropyl-1-ethoxypropan-2-yl]hydrazine?
[3-(5-bromothiophen-2-yl)-1-cyclopropyl-1-ethoxypropan-2-yl]hydrazine has a molecular weight of 319.27 g/mol, XLogP of 2.70, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(5-bromothiophen-2-yl)-1-cyclopropyl-1-ethoxypropan-2-yl]hydrazine is sourced from PubChem (CID 105272973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).