(3-amino-6,7-dihydro-5H-cyclopenta[f][1]benzofuran-2-yl)-(2-fluorophenyl)methanone

C18H14FNO2 — CID 58759569

IUPAC(3-amino-6,7-dihydro-5H-cyclopenta[f][1]benzofuran-2-yl)-(2-fluorophenyl)methanone
SMILESNc1c(C(=O)c2ccccc2F)oc2cc3c(cc12)CCC3
InChIInChI=1S/C18H14FNO2/c19-14-7-2-1-6-12(14)17(21)18-16(20)13-8-10-4-3-5-11(10)9-15(13)22-18/h1-2,6-9H,3-5,20H2
InChIKeyLQVIWZQKPHJCBX-UHFFFAOYSA-N
MW295.31 g/mol
LogP3.87
Rot. Bonds2

About (3-amino-6,7-dihydro-5H-cyclopenta[f][1]benzofuran-2-yl)-(2-fluorophenyl)methanone

(3-amino-6,7-dihydro-5H-cyclopenta[f][1]benzofuran-2-yl)-(2-fluorophenyl)methanone (PubChem CID 58759569) has the molecular formula C18H14FNO2 and a molecular weight of 295.31 g/mol. Its IUPAC name is (3-amino-6,7-dihydro-5H-cyclopenta[f][1]benzofuran-2-yl)-(2-fluorophenyl)methanone.

Molecular Properties

Compound Name(3-amino-6,7-dihydro-5H-cyclopenta[f][1]benzofuran-2-yl)-(2-fluorophenyl)methanone
PubChem CID58759569
Molecular FormulaC18H14FNO2
Molecular Weight295.31 g/mol
Exact Mass295.10
IUPAC Name(3-amino-6,7-dihydro-5H-cyclopenta[f][1]benzofuran-2-yl)-(2-fluorophenyl)methanone
SMILESNc1c(C(=O)c2ccccc2F)oc2cc3c(cc12)CCC3
InChIInChI=1S/C18H14FNO2/c19-14-7-2-1-6-12(14)17(21)18-16(20)13-8-10-4-3-5-11(10)9-15(13)22-18/h1-2,6-9H,3-5,20H2
InChIKeyLQVIWZQKPHJCBX-UHFFFAOYSA-N
XLogP3.87
TPSA56.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.31
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (3-amino-6,7-dihydro-5H-cyclopenta[f][1]benzofuran-2-yl)-(2-fluorophenyl)methanone 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

(3-Amino-1-benzofuran-2-YL)(4-methoxyphenyl)methanone
CID 693230
(3-Amino-1-benzofuran-2-yl)(4-methylphenyl)methanone
CID 619566
(3-Amino-5-methoxy-benzofuran-2-yl)-phenyl-methanone
CID 698980
(3-Amino-1-benzofuran-2-yl)(4-fluorophenyl)methanone
CID 620323
1-(3-Amino-1-benzofuran-2-yl)ethanone
CID 654095
(3-Amino-1-benzofuran-2-yl)(phenyl)methanone
CID 854225
(3-Amino-5-methoxy-1-benzofuran-2-yl)-(4-methoxyphenyl)methanone
CID 1088163
(3-Amino-5-methoxybenzofuran-2-yl)(4-fluorophenyl)methanone
CID 685511
N-{2-[(4-fluorophenyl)carbonyl]-1-benzofuran-3-yl}-7,8-dimethyl-4-oxo-4H-chromene-2-carboxamide
CID 16013518
2-Cyclopropanecarbonyl-1-benzofuran-3-amine
CID 608478
(3-Amino-7-meo-1-benzofuran-2-YL)(2',4'-difluoro(1,1'-biphenyl)-4-YL)methanone
CID 10499923
Ethyl (4-((3-amino-1-benzofuran-2-YL)carbonyl)phenoxy)acetate
CID 10664799

Frequently Asked Questions

What is the IUPAC name of (3-amino-6,7-dihydro-5H-cyclopenta[f][1]benzofuran-2-yl)-(2-fluorophenyl)methanone?
The IUPAC name of (3-amino-6,7-dihydro-5H-cyclopenta[f][1]benzofuran-2-yl)-(2-fluorophenyl)methanone (CID 58759569) is (3-amino-6,7-dihydro-5H-cyclopenta[f][1]benzofuran-2-yl)-(2-fluorophenyl)methanone.
What is the SMILES notation for (3-amino-6,7-dihydro-5H-cyclopenta[f][1]benzofuran-2-yl)-(2-fluorophenyl)methanone?
The canonical SMILES for (3-amino-6,7-dihydro-5H-cyclopenta[f][1]benzofuran-2-yl)-(2-fluorophenyl)methanone is Nc1c(C(=O)c2ccccc2F)oc2cc3c(cc12)CCC3.
What is the InChIKey of (3-amino-6,7-dihydro-5H-cyclopenta[f][1]benzofuran-2-yl)-(2-fluorophenyl)methanone?
The InChIKey is LQVIWZQKPHJCBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14FNO2/c19-14-7-2-1-6-12(14)17(21)18-16(20)13-8-10-4-3-5-11(10)9-15(13)22-18/h1-2,6-9H,3-5,20H2.
What are the key properties of (3-amino-6,7-dihydro-5H-cyclopenta[f][1]benzofuran-2-yl)-(2-fluorophenyl)methanone?
(3-amino-6,7-dihydro-5H-cyclopenta[f][1]benzofuran-2-yl)-(2-fluorophenyl)methanone has a molecular weight of 295.31 g/mol, XLogP of 3.87, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-amino-6,7-dihydro-5H-cyclopenta[f][1]benzofuran-2-yl)-(2-fluorophenyl)methanone is sourced from PubChem (CID 58759569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).