[(5-bromo-4-methylthiophen-2-yl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine

C14H18BrN3OS — CID 105330550

IUPAC[(5-bromo-4-methylthiophen-2-yl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine
SMILESCc1cc(C(NN)c2cncc(OC(C)C)c2)sc1Br
InChIInChI=1S/C14H18BrN3OS/c1-8(2)19-11-5-10(6-17-7-11)13(18-16)12-4-9(3)14(15)20-12/h4-8,13,18H,16H2,1-3H3
InChIKeyWSBGTSKJTOIICM-UHFFFAOYSA-N
MW356.29 g/mol
LogP3.55
Rot. Bonds5

About [(5-bromo-4-methylthiophen-2-yl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine

[(5-bromo-4-methylthiophen-2-yl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine (PubChem CID 105330550) has the molecular formula C14H18BrN3OS and a molecular weight of 356.29 g/mol. Its IUPAC name is [(5-bromo-4-methylthiophen-2-yl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine.

Molecular Properties

Compound Name[(5-bromo-4-methylthiophen-2-yl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine
PubChem CID105330550
Molecular FormulaC14H18BrN3OS
Molecular Weight356.29 g/mol
Exact Mass355.04
IUPAC Name[(5-bromo-4-methylthiophen-2-yl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine
SMILESCc1cc(C(NN)c2cncc(OC(C)C)c2)sc1Br
InChIInChI=1S/C14H18BrN3OS/c1-8(2)19-11-5-10(6-17-7-11)13(18-16)12-4-9(3)14(15)20-12/h4-8,13,18H,16H2,1-3H3
InChIKeyWSBGTSKJTOIICM-UHFFFAOYSA-N
XLogP3.55
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.29
LogP ≤ 53.55
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

(5-bromo-4-methylthiophen-2-yl)-(5-propan-2-yloxy-3-pyridinyl)methanamine
CID 105027542
[5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine
CID 105330505
[(3,4-dimethylphenyl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine
CID 105330468
[(3-bromothiophen-2-yl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine
CID 105330543
[(2,3-dimethylphenyl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine
CID 105330458
[(2-methyl-4-pyridinyl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine
CID 106756674
[(4,5-dimethylthiophen-2-yl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
CID 105330062
[(3-bromo-2-pyridinyl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine
CID 105268181
[(4-ethylphenyl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine
CID 105197467
[(5-propan-2-yloxy-3-pyridinyl)-pyrimidin-4-ylmethyl]hydrazine
CID 105221122
[2,2-dimethoxy-1-(5-propan-2-yloxy-3-pyridinyl)ethyl]hydrazine
CID 105246133
[(5-bromo-3-pyridinyl)-(4-propan-2-yloxyphenyl)methyl]hydrazine
CID 105251286

Frequently Asked Questions

What is the IUPAC name of [(5-bromo-4-methylthiophen-2-yl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine?
The IUPAC name of [(5-bromo-4-methylthiophen-2-yl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine (CID 105330550) is [(5-bromo-4-methylthiophen-2-yl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine.
What is the SMILES notation for [(5-bromo-4-methylthiophen-2-yl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine?
The canonical SMILES for [(5-bromo-4-methylthiophen-2-yl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine is Cc1cc(C(NN)c2cncc(OC(C)C)c2)sc1Br.
What is the InChIKey of [(5-bromo-4-methylthiophen-2-yl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine?
The InChIKey is WSBGTSKJTOIICM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18BrN3OS/c1-8(2)19-11-5-10(6-17-7-11)13(18-16)12-4-9(3)14(15)20-12/h4-8,13,18H,16H2,1-3H3.
What are the key properties of [(5-bromo-4-methylthiophen-2-yl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine?
[(5-bromo-4-methylthiophen-2-yl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine has a molecular weight of 356.29 g/mol, XLogP of 3.55, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(5-bromo-4-methylthiophen-2-yl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine is sourced from PubChem (CID 105330550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).