[(4,5-dimethylthiophen-2-yl)-(5-propoxy-3-pyridinyl)methyl]hydrazine

C15H21N3OS — CID 105330062

IUPAC[(4,5-dimethylthiophen-2-yl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
SMILESCCCOc1cncc(C(NN)c2cc(C)c(C)s2)c1
InChIInChI=1S/C15H21N3OS/c1-4-5-19-13-7-12(8-17-9-13)15(18-16)14-6-10(2)11(3)20-14/h6-9,15,18H,4-5,16H2,1-3H3
InChIKeyBOVQVBMCRHUAJL-UHFFFAOYSA-N
MW291.42 g/mol
LogP3.10
Rot. Bonds6

About [(4,5-dimethylthiophen-2-yl)-(5-propoxy-3-pyridinyl)methyl]hydrazine

[(4,5-dimethylthiophen-2-yl)-(5-propoxy-3-pyridinyl)methyl]hydrazine (PubChem CID 105330062) has the molecular formula C15H21N3OS and a molecular weight of 291.42 g/mol. Its IUPAC name is [(4,5-dimethylthiophen-2-yl)-(5-propoxy-3-pyridinyl)methyl]hydrazine.

Molecular Properties

Compound Name[(4,5-dimethylthiophen-2-yl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
PubChem CID105330062
Molecular FormulaC15H21N3OS
Molecular Weight291.42 g/mol
Exact Mass291.14
IUPAC Name[(4,5-dimethylthiophen-2-yl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
SMILESCCCOc1cncc(C(NN)c2cc(C)c(C)s2)c1
InChIInChI=1S/C15H21N3OS/c1-4-5-19-13-7-12(8-17-9-13)15(18-16)14-6-10(2)11(3)20-14/h6-9,15,18H,4-5,16H2,1-3H3
InChIKeyBOVQVBMCRHUAJL-UHFFFAOYSA-N
XLogP3.10
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.42
LogP ≤ 53.10
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

1-(4,5-dimethylthiophen-2-yl)-N-methyl-1-(5-propoxy-3-pyridinyl)methanamine
CID 105026807
[(5-propoxy-3-pyridinyl)-thieno[3,2-b]thiophen-5-ylmethyl]hydrazine
CID 105330163
[(5-propoxy-3-pyridinyl)-thiophen-2-ylmethyl]hydrazine
CID 105193764
[(4-methylthiophen-3-yl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
CID 105251939
[(4-methylthiadiazol-5-yl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
CID 105330043
[(2,5-dimethylphenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
CID 105330089
[(1,3-dimethylpyrazol-4-yl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
CID 102805151
[(3-ethylthiophen-2-yl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
CID 105330057
[(2-fluoro-4-methylphenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
CID 105330079
[(4,5-dimethylthiophen-2-yl)-(4-ethoxyphenyl)methyl]hydrazine
CID 105300674
[(3-chlorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
CID 105194775
[(3-fluorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
CID 105193158

Frequently Asked Questions

What is the IUPAC name of [(4,5-dimethylthiophen-2-yl)-(5-propoxy-3-pyridinyl)methyl]hydrazine?
The IUPAC name of [(4,5-dimethylthiophen-2-yl)-(5-propoxy-3-pyridinyl)methyl]hydrazine (CID 105330062) is [(4,5-dimethylthiophen-2-yl)-(5-propoxy-3-pyridinyl)methyl]hydrazine.
What is the SMILES notation for [(4,5-dimethylthiophen-2-yl)-(5-propoxy-3-pyridinyl)methyl]hydrazine?
The canonical SMILES for [(4,5-dimethylthiophen-2-yl)-(5-propoxy-3-pyridinyl)methyl]hydrazine is CCCOc1cncc(C(NN)c2cc(C)c(C)s2)c1.
What is the InChIKey of [(4,5-dimethylthiophen-2-yl)-(5-propoxy-3-pyridinyl)methyl]hydrazine?
The InChIKey is BOVQVBMCRHUAJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3OS/c1-4-5-19-13-7-12(8-17-9-13)15(18-16)14-6-10(2)11(3)20-14/h6-9,15,18H,4-5,16H2,1-3H3.
What are the key properties of [(4,5-dimethylthiophen-2-yl)-(5-propoxy-3-pyridinyl)methyl]hydrazine?
[(4,5-dimethylthiophen-2-yl)-(5-propoxy-3-pyridinyl)methyl]hydrazine has a molecular weight of 291.42 g/mol, XLogP of 3.10, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(4,5-dimethylthiophen-2-yl)-(5-propoxy-3-pyridinyl)methyl]hydrazine is sourced from PubChem (CID 105330062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).