[(7-chloro-1-benzofuran-2-yl)-thiophen-2-ylmethyl]hydrazine

C13H11ClN2OS — CID 105193697

IUPAC[(7-chloro-1-benzofuran-2-yl)-thiophen-2-ylmethyl]hydrazine
SMILESNNC(c1cc2cccc(Cl)c2o1)c1cccs1
InChIInChI=1S/C13H11ClN2OS/c14-9-4-1-3-8-7-10(17-13(8)9)12(16-15)11-5-2-6-18-11/h1-7,12,16H,15H2
InChIKeyZEVOSFWMMWPGOK-UHFFFAOYSA-N
MW278.76 g/mol
LogP3.70
Rot. Bonds3

About [(7-chloro-1-benzofuran-2-yl)-thiophen-2-ylmethyl]hydrazine

[(7-chloro-1-benzofuran-2-yl)-thiophen-2-ylmethyl]hydrazine (PubChem CID 105193697) has the molecular formula C13H11ClN2OS and a molecular weight of 278.76 g/mol. Its IUPAC name is [(7-chloro-1-benzofuran-2-yl)-thiophen-2-ylmethyl]hydrazine.

Molecular Properties

Compound Name[(7-chloro-1-benzofuran-2-yl)-thiophen-2-ylmethyl]hydrazine
PubChem CID105193697
Molecular FormulaC13H11ClN2OS
Molecular Weight278.76 g/mol
Exact Mass278.03
IUPAC Name[(7-chloro-1-benzofuran-2-yl)-thiophen-2-ylmethyl]hydrazine
SMILESNNC(c1cc2cccc(Cl)c2o1)c1cccs1
InChIInChI=1S/C13H11ClN2OS/c14-9-4-1-3-8-7-10(17-13(8)9)12(16-15)11-5-2-6-18-11/h1-7,12,16H,15H2
InChIKeyZEVOSFWMMWPGOK-UHFFFAOYSA-N
XLogP3.70
TPSA51.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.76
LogP ≤ 53.70
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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Related Compounds

[(7-chloro-1-benzofuran-2-yl)-(3-chloro-2-methylphenyl)methyl]hydrazine
CID 107103839
[(7-chloro-1-benzofuran-2-yl)-(3,5-dimethylphenyl)methyl]hydrazine
CID 105339711
[(5-chlorofuran-2-yl)-thiophen-2-ylmethyl]hydrazine
CID 106694198
[(3-bromo-2-chlorophenyl)-(7-chloro-1-benzofuran-2-yl)methyl]hydrazine
CID 105339723
[(2-bromo-3-methylphenyl)-(7-chloro-1-benzofuran-2-yl)methyl]hydrazine
CID 107986198
1-(7-chloro-1-benzofuran-2-yl)-1-(3-chlorothiophen-2-yl)-N-methylmethanamine
CID 105048424
[(7-chloro-1-benzofuran-2-yl)-(4-fluoro-2-methylphenyl)methyl]hydrazine
CID 105256705
[(7-chloro-1-benzofuran-2-yl)-(2-methyl-4-pyridinyl)methyl]hydrazine
CID 106756721
[(5-bromo-2-pyridinyl)-(7-chloro-1-benzofuran-2-yl)methyl]hydrazine
CID 105267826
[(3-bromo-2-pyridinyl)-(7-chloro-1-benzofuran-2-yl)methyl]hydrazine
CID 105268152
1-(5-bromo-4-methylthiophen-2-yl)-1-(7-chloro-1-benzofuran-2-yl)-N-methylmethanamine
CID 105048423
(7-chloro-1-benzofuran-2-yl)-(2,6-dichlorophenyl)methanamine
CID 105048440

Frequently Asked Questions

What is the IUPAC name of [(7-chloro-1-benzofuran-2-yl)-thiophen-2-ylmethyl]hydrazine?
The IUPAC name of [(7-chloro-1-benzofuran-2-yl)-thiophen-2-ylmethyl]hydrazine (CID 105193697) is [(7-chloro-1-benzofuran-2-yl)-thiophen-2-ylmethyl]hydrazine.
What is the SMILES notation for [(7-chloro-1-benzofuran-2-yl)-thiophen-2-ylmethyl]hydrazine?
The canonical SMILES for [(7-chloro-1-benzofuran-2-yl)-thiophen-2-ylmethyl]hydrazine is NNC(c1cc2cccc(Cl)c2o1)c1cccs1.
What is the InChIKey of [(7-chloro-1-benzofuran-2-yl)-thiophen-2-ylmethyl]hydrazine?
The InChIKey is ZEVOSFWMMWPGOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11ClN2OS/c14-9-4-1-3-8-7-10(17-13(8)9)12(16-15)11-5-2-6-18-11/h1-7,12,16H,15H2.
What are the key properties of [(7-chloro-1-benzofuran-2-yl)-thiophen-2-ylmethyl]hydrazine?
[(7-chloro-1-benzofuran-2-yl)-thiophen-2-ylmethyl]hydrazine has a molecular weight of 278.76 g/mol, XLogP of 3.70, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(7-chloro-1-benzofuran-2-yl)-thiophen-2-ylmethyl]hydrazine is sourced from PubChem (CID 105193697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).