1-benzofuran-2-yl-(2,3-dichlorophenyl)methanamine

C15H11Cl2NO — CID 63091124

IUPAC1-benzofuran-2-yl-(2,3-dichlorophenyl)methanamine
SMILESNC(c1cc2ccccc2o1)c1cccc(Cl)c1Cl
InChIInChI=1S/C15H11Cl2NO/c16-11-6-3-5-10(14(11)17)15(18)13-8-9-4-1-2-7-12(9)19-13/h1-8,15H,18H2
InChIKeyUHXNUQXSPVMPJK-UHFFFAOYSA-N
MW292.17 g/mol
LogP4.79
Rot. Bonds2

About 1-benzofuran-2-yl-(2,3-dichlorophenyl)methanamine

1-benzofuran-2-yl-(2,3-dichlorophenyl)methanamine (PubChem CID 63091124) has the molecular formula C15H11Cl2NO and a molecular weight of 292.17 g/mol. Its IUPAC name is 1-benzofuran-2-yl-(2,3-dichlorophenyl)methanamine.

Molecular Properties

Compound Name1-benzofuran-2-yl-(2,3-dichlorophenyl)methanamine
PubChem CID63091124
Molecular FormulaC15H11Cl2NO
Molecular Weight292.17 g/mol
Exact Mass291.02
IUPAC Name1-benzofuran-2-yl-(2,3-dichlorophenyl)methanamine
SMILESNC(c1cc2ccccc2o1)c1cccc(Cl)c1Cl
InChIInChI=1S/C15H11Cl2NO/c16-11-6-3-5-10(14(11)17)15(18)13-8-9-4-1-2-7-12(9)19-13/h1-8,15H,18H2
InChIKeyUHXNUQXSPVMPJK-UHFFFAOYSA-N
XLogP4.79
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.17
LogP ≤ 54.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2,3-dichlorophenyl)-(7-methyl-1-benzofuran-2-yl)methanamine
CID 105045662
1-benzofuran-2-yl-(5-bromo-2-chlorophenyl)methanamine
CID 105043963
1-benzofuran-2-yl-(2,3-dimethylphenyl)methanamine
CID 63090603
1-benzofuran-2-yl-(4-bromo-3-chloro-2-fluorophenyl)methanamine
CID 106762492
1-benzofuran-2-yl-(5-chlorofuran-2-yl)methanamine
CID 106693169
1-benzofuran-2-yl-(4-chlorophenyl)methanamine
CID 13048639
1-benzofuran-2-yl-(2,4,5-trimethylphenyl)methanamine
CID 60727883
1-benzofuran-2-yl-(5-chloro-2-methoxy-4-methylphenyl)methanamine
CID 67752088
1-benzofuran-2-yl-(3-chloro-2-methylphenyl)methanol
CID 107103499
1-(1-benzofuran-2-yl)-1-(3-chloro-2-methylphenyl)-N-methylmethanamine
CID 107103108
(2,3-dichlorophenyl)-quinolin-4-ylmethanamine
CID 105141880
(2,3-dichlorophenyl)-isoquinolin-5-ylmethanamine
CID 115853206

Frequently Asked Questions

What is the IUPAC name of 1-benzofuran-2-yl-(2,3-dichlorophenyl)methanamine?
The IUPAC name of 1-benzofuran-2-yl-(2,3-dichlorophenyl)methanamine (CID 63091124) is 1-benzofuran-2-yl-(2,3-dichlorophenyl)methanamine.
What is the SMILES notation for 1-benzofuran-2-yl-(2,3-dichlorophenyl)methanamine?
The canonical SMILES for 1-benzofuran-2-yl-(2,3-dichlorophenyl)methanamine is NC(c1cc2ccccc2o1)c1cccc(Cl)c1Cl.
What is the InChIKey of 1-benzofuran-2-yl-(2,3-dichlorophenyl)methanamine?
The InChIKey is UHXNUQXSPVMPJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11Cl2NO/c16-11-6-3-5-10(14(11)17)15(18)13-8-9-4-1-2-7-12(9)19-13/h1-8,15H,18H2.
What are the key properties of 1-benzofuran-2-yl-(2,3-dichlorophenyl)methanamine?
1-benzofuran-2-yl-(2,3-dichlorophenyl)methanamine has a molecular weight of 292.17 g/mol, XLogP of 4.79, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzofuran-2-yl-(2,3-dichlorophenyl)methanamine is sourced from PubChem (CID 63091124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).