1-(3-chloro-4-pyridinyl)oct-7-enylhydrazine

C13H20ClN3 — CID 107012984

IUPAC1-(3-chloro-4-pyridinyl)oct-7-enylhydrazine
SMILESC=CCCCCCC(NN)c1ccncc1Cl
InChIInChI=1S/C13H20ClN3/c1-2-3-4-5-6-7-13(17-15)11-8-9-16-10-12(11)14/h2,8-10,13,17H,1,3-7,15H2
InChIKeyFDOQACXELKWYOT-UHFFFAOYSA-N
MW253.78 g/mol
LogP3.38
Rot. Bonds8

About 1-(3-chloro-4-pyridinyl)oct-7-enylhydrazine

1-(3-chloro-4-pyridinyl)oct-7-enylhydrazine (PubChem CID 107012984) has the molecular formula C13H20ClN3 and a molecular weight of 253.78 g/mol. Its IUPAC name is 1-(3-chloro-4-pyridinyl)oct-7-enylhydrazine.

Molecular Properties

Compound Name1-(3-chloro-4-pyridinyl)oct-7-enylhydrazine
PubChem CID107012984
Molecular FormulaC13H20ClN3
Molecular Weight253.78 g/mol
Exact Mass253.13
IUPAC Name1-(3-chloro-4-pyridinyl)oct-7-enylhydrazine
SMILESC=CCCCCCC(NN)c1ccncc1Cl
InChIInChI=1S/C13H20ClN3/c1-2-3-4-5-6-7-13(17-15)11-8-9-16-10-12(11)14/h2,8-10,13,17H,1,3-7,15H2
InChIKeyFDOQACXELKWYOT-UHFFFAOYSA-N
XLogP3.38
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.78
LogP ≤ 53.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-(3-methyl-4-pyridinyl)hex-5-enylhydrazine
CID 105261752
1-(4-methyl-3-pyridinyl)hex-5-enylhydrazine
CID 105279755
[1-(3-chloro-4-pyridinyl)-3-cyclopropylpropyl]hydrazine
CID 105315159
1-(3,5-dichloro-2-pyridinyl)oct-7-enylhydrazine
CID 107012565
1-quinolin-4-yloct-7-enylhydrazine
CID 107013009
1-(2-bromo-4-chlorophenyl)oct-7-enylhydrazine
CID 107997433
1-(2,5-dichlorothiophen-3-yl)oct-7-enylhydrazine
CID 107970721
[1-(3-chloro-4-pyridinyl)-4-(oxolan-2-yl)butyl]hydrazine
CID 105314132
1-(2-bromofuran-3-yl)oct-7-enylhydrazine
CID 107012785
[1-(3-chloro-4-pyridinyl)-3-methylhexyl]hydrazine
CID 105298210
1-(5-chloro-2-fluorophenyl)hex-5-enylhydrazine
CID 105280013
4-fluoro-2-(1-hydrazinyloct-7-enyl)aniline
CID 107012619

Frequently Asked Questions

What is the IUPAC name of 1-(3-chloro-4-pyridinyl)oct-7-enylhydrazine?
The IUPAC name of 1-(3-chloro-4-pyridinyl)oct-7-enylhydrazine (CID 107012984) is 1-(3-chloro-4-pyridinyl)oct-7-enylhydrazine.
What is the SMILES notation for 1-(3-chloro-4-pyridinyl)oct-7-enylhydrazine?
The canonical SMILES for 1-(3-chloro-4-pyridinyl)oct-7-enylhydrazine is C=CCCCCCC(NN)c1ccncc1Cl.
What is the InChIKey of 1-(3-chloro-4-pyridinyl)oct-7-enylhydrazine?
The InChIKey is FDOQACXELKWYOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20ClN3/c1-2-3-4-5-6-7-13(17-15)11-8-9-16-10-12(11)14/h2,8-10,13,17H,1,3-7,15H2.
What are the key properties of 1-(3-chloro-4-pyridinyl)oct-7-enylhydrazine?
1-(3-chloro-4-pyridinyl)oct-7-enylhydrazine has a molecular weight of 253.78 g/mol, XLogP of 3.38, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chloro-4-pyridinyl)oct-7-enylhydrazine is sourced from PubChem (CID 107012984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).