[(3-bromothiophen-2-yl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine

C13H16BrN3OS — CID 105330543

IUPAC[(3-bromothiophen-2-yl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine
SMILESCC(C)Oc1cncc(C(NN)c2sccc2Br)c1
InChIInChI=1S/C13H16BrN3OS/c1-8(2)18-10-5-9(6-16-7-10)12(17-15)13-11(14)3-4-19-13/h3-8,12,17H,15H2,1-2H3
InChIKeyKIODUSSVNJMECI-UHFFFAOYSA-N
MW342.26 g/mol
LogP3.25
Rot. Bonds5

About [(3-bromothiophen-2-yl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine

[(3-bromothiophen-2-yl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine (PubChem CID 105330543) has the molecular formula C13H16BrN3OS and a molecular weight of 342.26 g/mol. Its IUPAC name is [(3-bromothiophen-2-yl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine.

Molecular Properties

Compound Name[(3-bromothiophen-2-yl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine
PubChem CID105330543
Molecular FormulaC13H16BrN3OS
Molecular Weight342.26 g/mol
Exact Mass341.02
IUPAC Name[(3-bromothiophen-2-yl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine
SMILESCC(C)Oc1cncc(C(NN)c2sccc2Br)c1
InChIInChI=1S/C13H16BrN3OS/c1-8(2)18-10-5-9(6-16-7-10)12(17-15)13-11(14)3-4-19-13/h3-8,12,17H,15H2,1-2H3
InChIKeyKIODUSSVNJMECI-UHFFFAOYSA-N
XLogP3.25
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.26
LogP ≤ 53.25
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'}

Analyze [(3-bromothiophen-2-yl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(3-bromothiophen-2-yl)-1-(5-methoxy-3-pyridinyl)-N-methylmethanamine
CID 105025777
[(3-bromo-2-pyridinyl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine
CID 105268181
[(5-bromo-4-methylthiophen-2-yl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine
CID 105330550
[(5-bromo-3-pyridinyl)-(4-propan-2-yloxyphenyl)methyl]hydrazine
CID 105251286
[(3-bromothiophen-2-yl)-pyridin-3-ylmethyl]hydrazine
CID 105196295
[(3,4-dimethylphenyl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine
CID 105330468
[(5-propan-2-yloxy-3-pyridinyl)-pyrimidin-4-ylmethyl]hydrazine
CID 105221122
[(4-ethylphenyl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine
CID 105197467
N-[(3-methylthiophen-2-yl)-(5-propan-2-yloxy-3-pyridinyl)methyl]ethanamine
CID 105027336
[(2-methyl-4-pyridinyl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine
CID 106756674
[(2,3-dimethylphenyl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine
CID 105330458
[(2-methylsulfanylphenyl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine
CID 105330517

Frequently Asked Questions

What is the IUPAC name of [(3-bromothiophen-2-yl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine?
The IUPAC name of [(3-bromothiophen-2-yl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine (CID 105330543) is [(3-bromothiophen-2-yl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine.
What is the SMILES notation for [(3-bromothiophen-2-yl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine?
The canonical SMILES for [(3-bromothiophen-2-yl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine is CC(C)Oc1cncc(C(NN)c2sccc2Br)c1.
What is the InChIKey of [(3-bromothiophen-2-yl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine?
The InChIKey is KIODUSSVNJMECI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16BrN3OS/c1-8(2)18-10-5-9(6-16-7-10)12(17-15)13-11(14)3-4-19-13/h3-8,12,17H,15H2,1-2H3.
What are the key properties of [(3-bromothiophen-2-yl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine?
[(3-bromothiophen-2-yl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine has a molecular weight of 342.26 g/mol, XLogP of 3.25, 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)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine is sourced from PubChem (CID 105330543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).