1-(3-chloro-2-pyridinyl)butylhydrazine

C9H14ClN3 — CID 103445669

IUPAC1-(3-chloro-2-pyridinyl)butylhydrazine
SMILESCCCC(NN)c1ncccc1Cl
InChIInChI=1S/C9H14ClN3/c1-2-4-8(13-11)9-7(10)5-3-6-12-9/h3,5-6,8,13H,2,4,11H2,1H3
InChIKeyJKVPVEUPGRSQKH-UHFFFAOYSA-N
MW199.69 g/mol
LogP2.04
Rot. Bonds4

About 1-(3-chloro-2-pyridinyl)butylhydrazine

1-(3-chloro-2-pyridinyl)butylhydrazine (PubChem CID 103445669) has the molecular formula C9H14ClN3 and a molecular weight of 199.69 g/mol. Its IUPAC name is 1-(3-chloro-2-pyridinyl)butylhydrazine.

Molecular Properties

Compound Name1-(3-chloro-2-pyridinyl)butylhydrazine
PubChem CID103445669
Molecular FormulaC9H14ClN3
Molecular Weight199.69 g/mol
Exact Mass199.09
IUPAC Name1-(3-chloro-2-pyridinyl)butylhydrazine
SMILESCCCC(NN)c1ncccc1Cl
InChIInChI=1S/C9H14ClN3/c1-2-4-8(13-11)9-7(10)5-3-6-12-9/h3,5-6,8,13H,2,4,11H2,1H3
InChIKeyJKVPVEUPGRSQKH-UHFFFAOYSA-N
XLogP2.04
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.69
LogP ≤ 52.04
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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Frequently Asked Questions

What is the IUPAC name of 1-(3-chloro-2-pyridinyl)butylhydrazine?
The IUPAC name of 1-(3-chloro-2-pyridinyl)butylhydrazine (CID 103445669) is 1-(3-chloro-2-pyridinyl)butylhydrazine.
What is the SMILES notation for 1-(3-chloro-2-pyridinyl)butylhydrazine?
The canonical SMILES for 1-(3-chloro-2-pyridinyl)butylhydrazine is CCCC(NN)c1ncccc1Cl.
What is the InChIKey of 1-(3-chloro-2-pyridinyl)butylhydrazine?
The InChIKey is JKVPVEUPGRSQKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14ClN3/c1-2-4-8(13-11)9-7(10)5-3-6-12-9/h3,5-6,8,13H,2,4,11H2,1H3.
What are the key properties of 1-(3-chloro-2-pyridinyl)butylhydrazine?
1-(3-chloro-2-pyridinyl)butylhydrazine has a molecular weight of 199.69 g/mol, XLogP of 2.04, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chloro-2-pyridinyl)butylhydrazine is sourced from PubChem (CID 103445669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).