(4-chloro-1-benzofuran-2-yl)-(2-chloro-4-fluorophenyl)methanamine

C15H10Cl2FNO — CID 114321348

IUPAC(4-chloro-1-benzofuran-2-yl)-(2-chloro-4-fluorophenyl)methanamine
SMILESNC(c1cc2c(Cl)cccc2o1)c1ccc(F)cc1Cl
InChIInChI=1S/C15H10Cl2FNO/c16-11-2-1-3-13-10(11)7-14(20-13)15(19)9-5-4-8(18)6-12(9)17/h1-7,15H,19H2
InChIKeyGZVZFYKOXIWFOZ-UHFFFAOYSA-N
MW310.16 g/mol
LogP4.93
Rot. Bonds2

About (4-chloro-1-benzofuran-2-yl)-(2-chloro-4-fluorophenyl)methanamine

(4-chloro-1-benzofuran-2-yl)-(2-chloro-4-fluorophenyl)methanamine (PubChem CID 114321348) has the molecular formula C15H10Cl2FNO and a molecular weight of 310.16 g/mol. Its IUPAC name is (4-chloro-1-benzofuran-2-yl)-(2-chloro-4-fluorophenyl)methanamine.

Molecular Properties

Compound Name(4-chloro-1-benzofuran-2-yl)-(2-chloro-4-fluorophenyl)methanamine
PubChem CID114321348
Molecular FormulaC15H10Cl2FNO
Molecular Weight310.16 g/mol
Exact Mass309.01
IUPAC Name(4-chloro-1-benzofuran-2-yl)-(2-chloro-4-fluorophenyl)methanamine
SMILESNC(c1cc2c(Cl)cccc2o1)c1ccc(F)cc1Cl
InChIInChI=1S/C15H10Cl2FNO/c16-11-2-1-3-13-10(11)7-14(20-13)15(19)9-5-4-8(18)6-12(9)17/h1-7,15H,19H2
InChIKeyGZVZFYKOXIWFOZ-UHFFFAOYSA-N
XLogP4.93
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.16
LogP ≤ 54.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (4-chloro-1-benzofuran-2-yl)-(2-chloro-4-fluorophenyl)methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(4-chloro-1-benzofuran-2-yl)-(4-fluorophenyl)methanamine
CID 114321381
(2-chloro-4-fluorophenyl)-(2-chlorophenyl)methanamine
CID 62945856
(2-chloro-4-fluorophenyl)-(7-fluoro-1-benzofuran-2-yl)methanamine
CID 115957488
(4-chloro-1-benzofuran-2-yl)-(4-chlorophenyl)methanamine
CID 114321372
(4-bromophenyl)-(4-chloro-1-benzofuran-2-yl)methanamine
CID 114321349
1-benzofuran-2-yl-(4-fluoro-2-methylphenyl)methanamine
CID 55182202
4-[amino-(4-chloro-1-benzofuran-2-yl)methyl]benzonitrile
CID 114321373
(4-chloro-1-benzofuran-2-yl)-(2-methylpyrazol-3-yl)methanamine
CID 106758771
(2-chloro-4-fluorophenyl)-(2,4,6-trifluorophenyl)methanamine
CID 43198689
(2-chloro-4-fluorophenyl)-(2,5-dichlorophenyl)methanamine
CID 43344688
1-(2-chloro-4-fluorophenyl)ethane-1,2-diamine
CID 55270283
(4-chloro-1-benzofuran-2-yl)-(1-methylpyrazol-4-yl)methanamine
CID 113277074

Frequently Asked Questions

What is the IUPAC name of (4-chloro-1-benzofuran-2-yl)-(2-chloro-4-fluorophenyl)methanamine?
The IUPAC name of (4-chloro-1-benzofuran-2-yl)-(2-chloro-4-fluorophenyl)methanamine (CID 114321348) is (4-chloro-1-benzofuran-2-yl)-(2-chloro-4-fluorophenyl)methanamine.
What is the SMILES notation for (4-chloro-1-benzofuran-2-yl)-(2-chloro-4-fluorophenyl)methanamine?
The canonical SMILES for (4-chloro-1-benzofuran-2-yl)-(2-chloro-4-fluorophenyl)methanamine is NC(c1cc2c(Cl)cccc2o1)c1ccc(F)cc1Cl.
What is the InChIKey of (4-chloro-1-benzofuran-2-yl)-(2-chloro-4-fluorophenyl)methanamine?
The InChIKey is GZVZFYKOXIWFOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10Cl2FNO/c16-11-2-1-3-13-10(11)7-14(20-13)15(19)9-5-4-8(18)6-12(9)17/h1-7,15H,19H2.
What are the key properties of (4-chloro-1-benzofuran-2-yl)-(2-chloro-4-fluorophenyl)methanamine?
(4-chloro-1-benzofuran-2-yl)-(2-chloro-4-fluorophenyl)methanamine has a molecular weight of 310.16 g/mol, XLogP of 4.93, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chloro-1-benzofuran-2-yl)-(2-chloro-4-fluorophenyl)methanamine is sourced from PubChem (CID 114321348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).