[1-(3-bromothiophen-2-yl)-3-propoxypropan-2-yl]hydrazine

C10H17BrN2OS — CID 105210102

IUPAC[1-(3-bromothiophen-2-yl)-3-propoxypropan-2-yl]hydrazine
SMILESCCCOCC(Cc1sccc1Br)NN
InChIInChI=1S/C10H17BrN2OS/c1-2-4-14-7-8(13-12)6-10-9(11)3-5-15-10/h3,5,8,13H,2,4,6-7,12H2,1H3
InChIKeyNGCGEOPKPFVOFG-UHFFFAOYSA-N
MW293.23 g/mol
LogP2.31
Rot. Bonds7

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

[1-(3-bromothiophen-2-yl)-3-propoxypropan-2-yl]hydrazine (PubChem CID 105210102) has the molecular formula C10H17BrN2OS and a molecular weight of 293.23 g/mol. Its IUPAC name is [1-(3-bromothiophen-2-yl)-3-propoxypropan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(3-bromothiophen-2-yl)-3-propoxypropan-2-yl]hydrazine
PubChem CID105210102
Molecular FormulaC10H17BrN2OS
Molecular Weight293.23 g/mol
Exact Mass292.02
IUPAC Name[1-(3-bromothiophen-2-yl)-3-propoxypropan-2-yl]hydrazine
SMILESCCCOCC(Cc1sccc1Br)NN
InChIInChI=1S/C10H17BrN2OS/c1-2-4-14-7-8(13-12)6-10-9(11)3-5-15-10/h3,5,8,13H,2,4,6-7,12H2,1H3
InChIKeyNGCGEOPKPFVOFG-UHFFFAOYSA-N
XLogP2.31
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.23
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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)-4-ethoxybutan-2-yl]hydrazine
CID 105299615
[1-(3-bromothiophen-2-yl)-3-(2,2,3,3-tetrafluoropropoxy)propan-2-yl]hydrazine
CID 103477808
1-(3-bromothiophen-2-yl)undecan-2-ylhydrazine
CID 105299478
1-(3-bromothiophen-2-yl)decan-2-ylhydrazine
CID 105299600
[1-(3-bromothiophen-2-yl)-4-(2-methoxyethoxy)butan-2-yl]hydrazine
CID 102929781
[1-(3-bromothiophen-2-yl)-2-propoxyethyl]hydrazine
CID 105210144
3-(3-bromothiophen-2-yl)-2-hydrazinyl-N,N-dimethylpropan-1-amine
CID 105244859
[1-(3-bromothiophen-2-yl)-5-methoxyhexan-2-yl]hydrazine
CID 105299566
4-(3-bromothiophen-2-yl)-3-hydrazinyl-N,N-dimethylbutan-1-amine
CID 105259328
[1-(3-bromothiophen-2-yl)-3-pyridin-4-ylpropan-2-yl]hydrazine
CID 105212499
1-(3-bromothiophen-2-yl)pent-4-en-2-ylhydrazine
CID 105269766
[1-(3-bromo-2,6-difluorophenyl)-3-propoxypropan-2-yl]hydrazine
CID 106270835

Frequently Asked Questions

What is the IUPAC name of [1-(3-bromothiophen-2-yl)-3-propoxypropan-2-yl]hydrazine?
The IUPAC name of [1-(3-bromothiophen-2-yl)-3-propoxypropan-2-yl]hydrazine (CID 105210102) is [1-(3-bromothiophen-2-yl)-3-propoxypropan-2-yl]hydrazine.
What is the SMILES notation for [1-(3-bromothiophen-2-yl)-3-propoxypropan-2-yl]hydrazine?
The canonical SMILES for [1-(3-bromothiophen-2-yl)-3-propoxypropan-2-yl]hydrazine is CCCOCC(Cc1sccc1Br)NN.
What is the InChIKey of [1-(3-bromothiophen-2-yl)-3-propoxypropan-2-yl]hydrazine?
The InChIKey is NGCGEOPKPFVOFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17BrN2OS/c1-2-4-14-7-8(13-12)6-10-9(11)3-5-15-10/h3,5,8,13H,2,4,6-7,12H2,1H3.
What are the key properties of [1-(3-bromothiophen-2-yl)-3-propoxypropan-2-yl]hydrazine?
[1-(3-bromothiophen-2-yl)-3-propoxypropan-2-yl]hydrazine has a molecular weight of 293.23 g/mol, XLogP of 2.31, 7 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-propoxypropan-2-yl]hydrazine is sourced from PubChem (CID 105210102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).