1-pyridin-2-ylhept-6-yn-3-ylhydrazine

C12H17N3 — CID 105307905

IUPAC1-pyridin-2-ylhept-6-yn-3-ylhydrazine
SMILESC#CCCC(CCc1ccccn1)NN
InChIInChI=1S/C12H17N3/c1-2-3-6-12(15-13)9-8-11-7-4-5-10-14-11/h1,4-5,7,10,12,15H,3,6,8-9,13H2
InChIKeyABYLFTCJGSZKMK-UHFFFAOYSA-N
MW203.29 g/mol
LogP1.26
Rot. Bonds6

About 1-pyridin-2-ylhept-6-yn-3-ylhydrazine

1-pyridin-2-ylhept-6-yn-3-ylhydrazine (PubChem CID 105307905) has the molecular formula C12H17N3 and a molecular weight of 203.29 g/mol. Its IUPAC name is 1-pyridin-2-ylhept-6-yn-3-ylhydrazine.

Molecular Properties

Compound Name1-pyridin-2-ylhept-6-yn-3-ylhydrazine
PubChem CID105307905
Molecular FormulaC12H17N3
Molecular Weight203.29 g/mol
Exact Mass203.14
IUPAC Name1-pyridin-2-ylhept-6-yn-3-ylhydrazine
SMILESC#CCCC(CCc1ccccn1)NN
InChIInChI=1S/C12H17N3/c1-2-3-6-12(15-13)9-8-11-7-4-5-10-14-11/h1,4-5,7,10,12,15H,3,6,8-9,13H2
InChIKeyABYLFTCJGSZKMK-UHFFFAOYSA-N
XLogP1.26
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.29
LogP ≤ 51.26
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-methyl-1-pyridin-2-ylhept-6-yn-3-amine
CID 105149167
N-methyl-1-pyridin-2-yloct-7-yn-3-amine
CID 105179646
(1-cyclopropyl-5-pyridin-2-ylpentan-3-yl)hydrazine
CID 105315136
(6-methoxy-1-pyridin-2-ylhexan-3-yl)hydrazine
CID 105342539
(1-pyridin-2-yl-5-thiophen-3-ylpentan-3-yl)hydrazine
CID 105306797
(1-cyclobutyl-4-pyridin-2-ylbutan-2-yl)hydrazine
CID 105310094
(6-methylsulfonyl-1-pyridin-2-ylhexan-3-yl)hydrazine
CID 105290925
(5-methyl-1-pyridin-2-yloctan-3-yl)hydrazine
CID 105298189
(4-pyridin-2-yl-1-thiophen-2-ylbutan-2-yl)hydrazine
CID 105295527
[1-(furan-2-yl)-4-pyridin-2-ylbutan-2-yl]hydrazine
CID 105331567
[1-(1-methylpyrazol-3-yl)-4-pyridin-2-ylbutan-2-yl]hydrazine
CID 105329556
1-phenylmethoxyhept-6-yn-3-ylhydrazine
CID 130923307

Frequently Asked Questions

What is the IUPAC name of 1-pyridin-2-ylhept-6-yn-3-ylhydrazine?
The IUPAC name of 1-pyridin-2-ylhept-6-yn-3-ylhydrazine (CID 105307905) is 1-pyridin-2-ylhept-6-yn-3-ylhydrazine.
What is the SMILES notation for 1-pyridin-2-ylhept-6-yn-3-ylhydrazine?
The canonical SMILES for 1-pyridin-2-ylhept-6-yn-3-ylhydrazine is C#CCCC(CCc1ccccn1)NN.
What is the InChIKey of 1-pyridin-2-ylhept-6-yn-3-ylhydrazine?
The InChIKey is ABYLFTCJGSZKMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3/c1-2-3-6-12(15-13)9-8-11-7-4-5-10-14-11/h1,4-5,7,10,12,15H,3,6,8-9,13H2.
What are the key properties of 1-pyridin-2-ylhept-6-yn-3-ylhydrazine?
1-pyridin-2-ylhept-6-yn-3-ylhydrazine has a molecular weight of 203.29 g/mol, XLogP of 1.26, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pyridin-2-ylhept-6-yn-3-ylhydrazine is sourced from PubChem (CID 105307905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).