[(4-bromothiophen-3-yl)-(3-chloro-2-pyridinyl)methyl]hydrazine

C10H9BrClN3S — CID 103445884

IUPAC[(4-bromothiophen-3-yl)-(3-chloro-2-pyridinyl)methyl]hydrazine
SMILESNNC(c1cscc1Br)c1ncccc1Cl
InChIInChI=1S/C10H9BrClN3S/c11-7-5-16-4-6(7)9(15-13)10-8(12)2-1-3-14-10/h1-5,9,15H,13H2
InChIKeyLXCZHZBLIPZRQJ-UHFFFAOYSA-N
MW318.63 g/mol
LogP3.11
Rot. Bonds3

About [(4-bromothiophen-3-yl)-(3-chloro-2-pyridinyl)methyl]hydrazine

[(4-bromothiophen-3-yl)-(3-chloro-2-pyridinyl)methyl]hydrazine (PubChem CID 103445884) has the molecular formula C10H9BrClN3S and a molecular weight of 318.63 g/mol. Its IUPAC name is [(4-bromothiophen-3-yl)-(3-chloro-2-pyridinyl)methyl]hydrazine.

Molecular Properties

Compound Name[(4-bromothiophen-3-yl)-(3-chloro-2-pyridinyl)methyl]hydrazine
PubChem CID103445884
Molecular FormulaC10H9BrClN3S
Molecular Weight318.63 g/mol
Exact Mass316.94
IUPAC Name[(4-bromothiophen-3-yl)-(3-chloro-2-pyridinyl)methyl]hydrazine
SMILESNNC(c1cscc1Br)c1ncccc1Cl
InChIInChI=1S/C10H9BrClN3S/c11-7-5-16-4-6(7)9(15-13)10-8(12)2-1-3-14-10/h1-5,9,15H,13H2
InChIKeyLXCZHZBLIPZRQJ-UHFFFAOYSA-N
XLogP3.11
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.63
LogP ≤ 53.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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 [(4-bromothiophen-3-yl)-(3-chloro-2-pyridinyl)methyl]hydrazine?
The IUPAC name of [(4-bromothiophen-3-yl)-(3-chloro-2-pyridinyl)methyl]hydrazine (CID 103445884) is [(4-bromothiophen-3-yl)-(3-chloro-2-pyridinyl)methyl]hydrazine.
What is the SMILES notation for [(4-bromothiophen-3-yl)-(3-chloro-2-pyridinyl)methyl]hydrazine?
The canonical SMILES for [(4-bromothiophen-3-yl)-(3-chloro-2-pyridinyl)methyl]hydrazine is NNC(c1cscc1Br)c1ncccc1Cl.
What is the InChIKey of [(4-bromothiophen-3-yl)-(3-chloro-2-pyridinyl)methyl]hydrazine?
The InChIKey is LXCZHZBLIPZRQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9BrClN3S/c11-7-5-16-4-6(7)9(15-13)10-8(12)2-1-3-14-10/h1-5,9,15H,13H2.
What are the key properties of [(4-bromothiophen-3-yl)-(3-chloro-2-pyridinyl)methyl]hydrazine?
[(4-bromothiophen-3-yl)-(3-chloro-2-pyridinyl)methyl]hydrazine has a molecular weight of 318.63 g/mol, XLogP of 3.11, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-bromothiophen-3-yl)-(3-chloro-2-pyridinyl)methyl]hydrazine is sourced from PubChem (CID 103445884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).