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

C10H9BrClN3S — CID 105252869

IUPAC[(3-bromothiophen-2-yl)-(2-chloro-4-pyridinyl)methyl]hydrazine
SMILESNNC(c1ccnc(Cl)c1)c1sccc1Br
InChIInChI=1S/C10H9BrClN3S/c11-7-2-4-16-10(7)9(15-13)6-1-3-14-8(12)5-6/h1-5,9,15H,13H2
InChIKeyRAUIWVJBSLBUOJ-UHFFFAOYSA-N
MW318.63 g/mol
LogP3.11
Rot. Bonds3

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

[(3-bromothiophen-2-yl)-(2-chloro-4-pyridinyl)methyl]hydrazine (PubChem CID 105252869) has the molecular formula C10H9BrClN3S and a molecular weight of 318.63 g/mol. Its IUPAC name is [(3-bromothiophen-2-yl)-(2-chloro-4-pyridinyl)methyl]hydrazine.

Molecular Properties

Compound Name[(3-bromothiophen-2-yl)-(2-chloro-4-pyridinyl)methyl]hydrazine
PubChem CID105252869
Molecular FormulaC10H9BrClN3S
Molecular Weight318.63 g/mol
Exact Mass316.94
IUPAC Name[(3-bromothiophen-2-yl)-(2-chloro-4-pyridinyl)methyl]hydrazine
SMILESNNC(c1ccnc(Cl)c1)c1sccc1Br
InChIInChI=1S/C10H9BrClN3S/c11-7-2-4-16-10(7)9(15-13)6-1-3-14-8(12)5-6/h1-5,9,15H,13H2
InChIKeyRAUIWVJBSLBUOJ-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': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[(3-bromothiophen-2-yl)-pyridin-3-ylmethyl]hydrazine
CID 105196295
[(3-bromothiophen-2-yl)-(3,4,5-trifluorophenyl)methyl]hydrazine
CID 105208216
[(3-bromothiophen-2-yl)-(4-bromothiophen-2-yl)methyl]hydrazine
CID 105222634
[(3-bromothiophen-2-yl)-(furan-2-yl)methyl]hydrazine
CID 105213683
[(5-bromo-2-pyridinyl)-(3-bromothiophen-2-yl)methyl]hydrazine
CID 105267899
[(3-bromothiophen-2-yl)-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]hydrazine
CID 105302932
[(3-bromothiophen-2-yl)-(2-chloro-4-fluorophenyl)methyl]hydrazine
CID 105215506
[(3-bromothiophen-2-yl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine
CID 105330543
3-[(2-chloro-4-pyridinyl)-hydrazinylmethyl]pyridin-2-amine
CID 105252731
[(2-chloro-4-pyridinyl)-[4-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105252881
[(3-bromothiophen-2-yl)-(4-methoxythiophen-2-yl)methyl]hydrazine
CID 105327987
[(3-bromothiophen-2-yl)-(3-methyl-4-pyridinyl)methyl]hydrazine
CID 105261993

Frequently Asked Questions

What is the IUPAC name of [(3-bromothiophen-2-yl)-(2-chloro-4-pyridinyl)methyl]hydrazine?
The IUPAC name of [(3-bromothiophen-2-yl)-(2-chloro-4-pyridinyl)methyl]hydrazine (CID 105252869) is [(3-bromothiophen-2-yl)-(2-chloro-4-pyridinyl)methyl]hydrazine.
What is the SMILES notation for [(3-bromothiophen-2-yl)-(2-chloro-4-pyridinyl)methyl]hydrazine?
The canonical SMILES for [(3-bromothiophen-2-yl)-(2-chloro-4-pyridinyl)methyl]hydrazine is NNC(c1ccnc(Cl)c1)c1sccc1Br.
What is the InChIKey of [(3-bromothiophen-2-yl)-(2-chloro-4-pyridinyl)methyl]hydrazine?
The InChIKey is RAUIWVJBSLBUOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9BrClN3S/c11-7-2-4-16-10(7)9(15-13)6-1-3-14-8(12)5-6/h1-5,9,15H,13H2.
What are the key properties of [(3-bromothiophen-2-yl)-(2-chloro-4-pyridinyl)methyl]hydrazine?
[(3-bromothiophen-2-yl)-(2-chloro-4-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 [(3-bromothiophen-2-yl)-(2-chloro-4-pyridinyl)methyl]hydrazine is sourced from PubChem (CID 105252869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).