[1-(3-chloro-4-pyridinyl)-3-methylhexyl]hydrazine

C12H20ClN3 — CID 105298210

IUPAC[1-(3-chloro-4-pyridinyl)-3-methylhexyl]hydrazine
SMILESCCCC(C)CC(NN)c1ccncc1Cl
InChIInChI=1S/C12H20ClN3/c1-3-4-9(2)7-12(16-14)10-5-6-15-8-11(10)13/h5-6,8-9,12,16H,3-4,7,14H2,1-2H3
InChIKeyMNLCKAXXWAMULA-UHFFFAOYSA-N
MW241.77 g/mol
LogP3.07
Rot. Bonds6

About [1-(3-chloro-4-pyridinyl)-3-methylhexyl]hydrazine

[1-(3-chloro-4-pyridinyl)-3-methylhexyl]hydrazine (PubChem CID 105298210) has the molecular formula C12H20ClN3 and a molecular weight of 241.77 g/mol. Its IUPAC name is [1-(3-chloro-4-pyridinyl)-3-methylhexyl]hydrazine.

Molecular Properties

Compound Name[1-(3-chloro-4-pyridinyl)-3-methylhexyl]hydrazine
PubChem CID105298210
Molecular FormulaC12H20ClN3
Molecular Weight241.77 g/mol
Exact Mass241.13
IUPAC Name[1-(3-chloro-4-pyridinyl)-3-methylhexyl]hydrazine
SMILESCCCC(C)CC(NN)c1ccncc1Cl
InChIInChI=1S/C12H20ClN3/c1-3-4-9(2)7-12(16-14)10-5-6-15-8-11(10)13/h5-6,8-9,12,16H,3-4,7,14H2,1-2H3
InChIKeyMNLCKAXXWAMULA-UHFFFAOYSA-N
XLogP3.07
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.77
LogP ≤ 53.07
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'}

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Related Compounds

1-(3-chloro-4-pyridinyl)-N,3-dimethylpentan-1-amine
CID 105138462
[1-(2,3-dichlorophenyl)-3-methylhexyl]hydrazine
CID 105298136
1-(3-chloro-4-pyridinyl)-N-ethyl-3,5-dimethylhexan-1-amine
CID 114201768
[1-(3-chloro-4-pyridinyl)-3-cyclopropylpropyl]hydrazine
CID 105315159
1-(3-chloro-4-pyridinyl)-N-methylpentan-1-amine
CID 105125649
[1-(3,5-dichloro-2-pyridinyl)-3-methylhexyl]hydrazine
CID 105248695
[2-(4-tert-butylphenyl)-1-(3-chloro-4-pyridinyl)ethyl]hydrazine
CID 105296557
1-(3-chloro-4-pyridinyl)-N,4-dimethylpentan-1-amine
CID 105127189
1-(3-chloro-4-pyridinyl)oct-7-enylhydrazine
CID 107012984
1-(3-chloro-4-pyridinyl)-3-ethyl-N-methylheptan-1-amine
CID 105103285
1-(3-chloro-4-pyridinyl)pentan-1-amine
CID 55270416
[1-(3-chloro-4-pyridinyl)-2-(2,5-dimethylphenyl)ethyl]hydrazine
CID 105287759

Frequently Asked Questions

What is the IUPAC name of [1-(3-chloro-4-pyridinyl)-3-methylhexyl]hydrazine?
The IUPAC name of [1-(3-chloro-4-pyridinyl)-3-methylhexyl]hydrazine (CID 105298210) is [1-(3-chloro-4-pyridinyl)-3-methylhexyl]hydrazine.
What is the SMILES notation for [1-(3-chloro-4-pyridinyl)-3-methylhexyl]hydrazine?
The canonical SMILES for [1-(3-chloro-4-pyridinyl)-3-methylhexyl]hydrazine is CCCC(C)CC(NN)c1ccncc1Cl.
What is the InChIKey of [1-(3-chloro-4-pyridinyl)-3-methylhexyl]hydrazine?
The InChIKey is MNLCKAXXWAMULA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20ClN3/c1-3-4-9(2)7-12(16-14)10-5-6-15-8-11(10)13/h5-6,8-9,12,16H,3-4,7,14H2,1-2H3.
What are the key properties of [1-(3-chloro-4-pyridinyl)-3-methylhexyl]hydrazine?
[1-(3-chloro-4-pyridinyl)-3-methylhexyl]hydrazine has a molecular weight of 241.77 g/mol, XLogP of 3.07, 6 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)-3-methylhexyl]hydrazine is sourced from PubChem (CID 105298210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).