(2,3-difluorophenyl)-(1,3-dihydro-2-benzofuran-5-yl)methanamine

C15H13F2NO — CID 63019519

IUPAC(2,3-difluorophenyl)-(1,3-dihydro-2-benzofuran-5-yl)methanamine
SMILESNC(c1ccc2c(c1)COC2)c1cccc(F)c1F
InChIInChI=1S/C15H13F2NO/c16-13-3-1-2-12(14(13)17)15(18)9-4-5-10-7-19-8-11(10)6-9/h1-6,15H,7-8,18H2
InChIKeyGXTZRVSFKNAKLI-UHFFFAOYSA-N
MW261.27 g/mol
LogP3.04
Rot. Bonds2

About (2,3-difluorophenyl)-(1,3-dihydro-2-benzofuran-5-yl)methanamine

(2,3-difluorophenyl)-(1,3-dihydro-2-benzofuran-5-yl)methanamine (PubChem CID 63019519) has the molecular formula C15H13F2NO and a molecular weight of 261.27 g/mol. Its IUPAC name is (2,3-difluorophenyl)-(1,3-dihydro-2-benzofuran-5-yl)methanamine.

Molecular Properties

Compound Name(2,3-difluorophenyl)-(1,3-dihydro-2-benzofuran-5-yl)methanamine
PubChem CID63019519
Molecular FormulaC15H13F2NO
Molecular Weight261.27 g/mol
Exact Mass261.10
IUPAC Name(2,3-difluorophenyl)-(1,3-dihydro-2-benzofuran-5-yl)methanamine
SMILESNC(c1ccc2c(c1)COC2)c1cccc(F)c1F
InChIInChI=1S/C15H13F2NO/c16-13-3-1-2-12(14(13)17)15(18)9-4-5-10-7-19-8-11(10)6-9/h1-6,15H,7-8,18H2
InChIKeyGXTZRVSFKNAKLI-UHFFFAOYSA-N
XLogP3.04
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.27
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2,3-difluorophenyl)-(1,3-dihydro-2-benzofuran-5-yl)methanamine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2,3-difluorophenyl)-(1,3-dihydro-2-benzofuran-5-yl)methanamine?
The IUPAC name of (2,3-difluorophenyl)-(1,3-dihydro-2-benzofuran-5-yl)methanamine (CID 63019519) is (2,3-difluorophenyl)-(1,3-dihydro-2-benzofuran-5-yl)methanamine.
What is the SMILES notation for (2,3-difluorophenyl)-(1,3-dihydro-2-benzofuran-5-yl)methanamine?
The canonical SMILES for (2,3-difluorophenyl)-(1,3-dihydro-2-benzofuran-5-yl)methanamine is NC(c1ccc2c(c1)COC2)c1cccc(F)c1F.
What is the InChIKey of (2,3-difluorophenyl)-(1,3-dihydro-2-benzofuran-5-yl)methanamine?
The InChIKey is GXTZRVSFKNAKLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13F2NO/c16-13-3-1-2-12(14(13)17)15(18)9-4-5-10-7-19-8-11(10)6-9/h1-6,15H,7-8,18H2.
What are the key properties of (2,3-difluorophenyl)-(1,3-dihydro-2-benzofuran-5-yl)methanamine?
(2,3-difluorophenyl)-(1,3-dihydro-2-benzofuran-5-yl)methanamine has a molecular weight of 261.27 g/mol, XLogP of 3.04, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2,3-difluorophenyl)-(1,3-dihydro-2-benzofuran-5-yl)methanamine is sourced from PubChem (CID 63019519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).