4-fluoro-N-[2-(3-methoxybenzoyl)-1-benzofuran-3-yl]benzamide

C23H16FNO4 — CID 18829898

IUPAC4-fluoro-N-[2-(3-methoxybenzoyl)-1-benzofuran-3-yl]benzamide
SMILESCOc1cccc(C(=O)c2oc3ccccc3c2NC(=O)c2ccc(F)cc2)c1
InChIInChI=1S/C23H16FNO4/c1-28-17-6-4-5-15(13-17)21(26)22-20(18-7-2-3-8-19(18)29-22)25-23(27)14-9-11-16(24)12-10-14/h2-13H,1H3,(H,25,27)
InChIKeyBSVQGXQIOGHMRZ-UHFFFAOYSA-N
MW389.38 g/mol
LogP5.06
Rot. Bonds5

About 4-fluoro-N-[2-(3-methoxybenzoyl)-1-benzofuran-3-yl]benzamide

4-fluoro-N-[2-(3-methoxybenzoyl)-1-benzofuran-3-yl]benzamide (PubChem CID 18829898) has the molecular formula C23H16FNO4 and a molecular weight of 389.38 g/mol. Its IUPAC name is 4-fluoro-N-[2-(3-methoxybenzoyl)-1-benzofuran-3-yl]benzamide.

Molecular Properties

Compound Name4-fluoro-N-[2-(3-methoxybenzoyl)-1-benzofuran-3-yl]benzamide
PubChem CID18829898
Molecular FormulaC23H16FNO4
Molecular Weight389.38 g/mol
Exact Mass389.11
IUPAC Name4-fluoro-N-[2-(3-methoxybenzoyl)-1-benzofuran-3-yl]benzamide
SMILESCOc1cccc(C(=O)c2oc3ccccc3c2NC(=O)c2ccc(F)cc2)c1
InChIInChI=1S/C23H16FNO4/c1-28-17-6-4-5-15(13-17)21(26)22-20(18-7-2-3-8-19(18)29-22)25-23(27)14-9-11-16(24)12-10-14/h2-13H,1H3,(H,25,27)
InChIKeyBSVQGXQIOGHMRZ-UHFFFAOYSA-N
XLogP5.06
TPSA68.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500389.38
LogP ≤ 55.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(4-fluorobenzoyl)-1-benzofuran-3-yl]-3-methylbenzamide
CID 4072165
N-(3-fluorophenyl)-3-[(3-methoxybenzoyl)amino]-1-benzofuran-2-carboxamide
CID 20875257
N-[2-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-1-benzofuran-3-yl]-4-fluorobenzamide
CID 23473376
3-ethoxy-N-[2-(3-fluoro-4-methylbenzoyl)-1-benzofuran-3-yl]benzamide
CID 18848100
3,4,5-trimethoxy-N-[2-(4-methoxybenzoyl)-1-benzofuran-3-yl]benzamide
CID 3445711
3-[(4-fluorobenzoyl)amino]-6-methoxy-1-benzofuran-2-carboxamide
CID 23148999
N-[2-(azepane-1-carbonyl)-1-benzofuran-3-yl]-3-methoxybenzamide
CID 20926272
N-[2-(4-fluorobenzoyl)-1-benzofuran-3-yl]-2,5-dimethoxybenzenesulfonamide
CID 35346351
3-methoxy-N-[2-(4-methylpiperazine-1-carbonyl)-1-benzofuran-3-yl]benzamide
CID 20926069
4-[(3-fluorophenyl)methyl]-N-[2-(3-methoxybenzoyl)-1-benzofuran-3-yl]thieno[3,2-b]pyrrole-5-carboxamide
CID 98475464
4-fluoro-N-[2-[4-(4-methoxyphenyl)piperazine-1-carbonyl]-1-benzofuran-3-yl]benzamide
CID 20925911
3-butoxy-N-[2-(3-chloro-4-methoxybenzoyl)-1-benzofuran-3-yl]benzamide
CID 18848018

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-[2-(3-methoxybenzoyl)-1-benzofuran-3-yl]benzamide?
The IUPAC name of 4-fluoro-N-[2-(3-methoxybenzoyl)-1-benzofuran-3-yl]benzamide (CID 18829898) is 4-fluoro-N-[2-(3-methoxybenzoyl)-1-benzofuran-3-yl]benzamide.
What is the SMILES notation for 4-fluoro-N-[2-(3-methoxybenzoyl)-1-benzofuran-3-yl]benzamide?
The canonical SMILES for 4-fluoro-N-[2-(3-methoxybenzoyl)-1-benzofuran-3-yl]benzamide is COc1cccc(C(=O)c2oc3ccccc3c2NC(=O)c2ccc(F)cc2)c1.
What is the InChIKey of 4-fluoro-N-[2-(3-methoxybenzoyl)-1-benzofuran-3-yl]benzamide?
The InChIKey is BSVQGXQIOGHMRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H16FNO4/c1-28-17-6-4-5-15(13-17)21(26)22-20(18-7-2-3-8-19(18)29-22)25-23(27)14-9-11-16(24)12-10-14/h2-13H,1H3,(H,25,27).
What are the key properties of 4-fluoro-N-[2-(3-methoxybenzoyl)-1-benzofuran-3-yl]benzamide?
4-fluoro-N-[2-(3-methoxybenzoyl)-1-benzofuran-3-yl]benzamide has a molecular weight of 389.38 g/mol, XLogP of 5.06, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-[2-(3-methoxybenzoyl)-1-benzofuran-3-yl]benzamide is sourced from PubChem (CID 18829898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).