1-(2-methyl-3-pyridinyl)but-3-ynylhydrazine

C10H13N3 — CID 105281507

IUPAC1-(2-methyl-3-pyridinyl)but-3-ynylhydrazine
SMILESC#CCC(NN)c1cccnc1C
InChIInChI=1S/C10H13N3/c1-3-5-10(13-11)9-6-4-7-12-8(9)2/h1,4,6-7,10,13H,5,11H2,2H3
InChIKeyQPLWWRHVACWMGN-UHFFFAOYSA-N
MW175.24 g/mol
LogP0.92
Rot. Bonds3

About 1-(2-methyl-3-pyridinyl)but-3-ynylhydrazine

1-(2-methyl-3-pyridinyl)but-3-ynylhydrazine (PubChem CID 105281507) has the molecular formula C10H13N3 and a molecular weight of 175.24 g/mol. Its IUPAC name is 1-(2-methyl-3-pyridinyl)but-3-ynylhydrazine.

Molecular Properties

Compound Name1-(2-methyl-3-pyridinyl)but-3-ynylhydrazine
PubChem CID105281507
Molecular FormulaC10H13N3
Molecular Weight175.24 g/mol
Exact Mass175.11
IUPAC Name1-(2-methyl-3-pyridinyl)but-3-ynylhydrazine
SMILESC#CCC(NN)c1cccnc1C
InChIInChI=1S/C10H13N3/c1-3-5-10(13-11)9-6-4-7-12-8(9)2/h1,4,6-7,10,13H,5,11H2,2H3
InChIKeyQPLWWRHVACWMGN-UHFFFAOYSA-N
XLogP0.92
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.24
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

N-ethyl-1-(2-methyl-3-pyridinyl)but-3-yn-1-amine
CID 105077584
1-(2-methyl-3-pyridinyl)hex-4-ynylhydrazine
CID 105334994
1-(2-methyl-3-pyridinyl)but-3-enylhydrazine
CID 105289607
[2-(4-fluorophenyl)-1-(2-methyl-3-pyridinyl)ethyl]hydrazine
CID 105283767
[1-(2-methyl-3-pyridinyl)-2-(4-propan-2-ylphenyl)ethyl]hydrazine
CID 105297269
N-methyl-1-quinolin-8-ylbut-3-yn-1-amine
CID 105077186
(1R)-2-amino-1-(2-methyl-3-pyridinyl)ethanol
CID 96635768
N-ethyl-1-(3-methyl-2-pyridinyl)but-3-yn-1-amine
CID 62235339
(1S)-1-(2-methyl-3-pyridinyl)ethanamine
CID 94864826
[2-(5-bromo-2-fluorophenyl)-1-(2-methyl-3-pyridinyl)ethyl]hydrazine
CID 105294921
1-quinolin-5-ylpent-3-ynylhydrazine
CID 105290528
1-(4-ethoxyphenyl)but-3-ynylhydrazine
CID 105281456

Frequently Asked Questions

What is the IUPAC name of 1-(2-methyl-3-pyridinyl)but-3-ynylhydrazine?
The IUPAC name of 1-(2-methyl-3-pyridinyl)but-3-ynylhydrazine (CID 105281507) is 1-(2-methyl-3-pyridinyl)but-3-ynylhydrazine.
What is the SMILES notation for 1-(2-methyl-3-pyridinyl)but-3-ynylhydrazine?
The canonical SMILES for 1-(2-methyl-3-pyridinyl)but-3-ynylhydrazine is C#CCC(NN)c1cccnc1C.
What is the InChIKey of 1-(2-methyl-3-pyridinyl)but-3-ynylhydrazine?
The InChIKey is QPLWWRHVACWMGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3/c1-3-5-10(13-11)9-6-4-7-12-8(9)2/h1,4,6-7,10,13H,5,11H2,2H3.
What are the key properties of 1-(2-methyl-3-pyridinyl)but-3-ynylhydrazine?
1-(2-methyl-3-pyridinyl)but-3-ynylhydrazine has a molecular weight of 175.24 g/mol, XLogP of 0.92, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methyl-3-pyridinyl)but-3-ynylhydrazine is sourced from PubChem (CID 105281507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).