N-(2-fluorophenyl)-3,4-dimethoxybenzamide

C15H14FNO3 — CID 774073

IUPACN-(2-fluorophenyl)-3,4-dimethoxybenzamide
SMILESCOc1ccc(C(=O)Nc2ccccc2F)cc1OC
InChIInChI=1S/C15H14FNO3/c1-19-13-8-7-10(9-14(13)20-2)15(18)17-12-6-4-3-5-11(12)16/h3-9H,1-2H3,(H,17,18)
InChIKeySBWZRQSRNWBKRE-UHFFFAOYSA-N
MW275.28 g/mol
LogP3.10
Rot. Bonds4

About N-(2-fluorophenyl)-3,4-dimethoxybenzamide

N-(2-fluorophenyl)-3,4-dimethoxybenzamide (PubChem CID 774073) has the molecular formula C15H14FNO3 and a molecular weight of 275.28 g/mol. Its IUPAC name is N-(2-fluorophenyl)-3,4-dimethoxybenzamide.

Molecular Properties

Compound NameN-(2-fluorophenyl)-3,4-dimethoxybenzamide
PubChem CID774073
Molecular FormulaC15H14FNO3
Molecular Weight275.28 g/mol
Exact Mass275.10
IUPAC NameN-(2-fluorophenyl)-3,4-dimethoxybenzamide
SMILESCOc1ccc(C(=O)Nc2ccccc2F)cc1OC
InChIInChI=1S/C15H14FNO3/c1-19-13-8-7-10(9-14(13)20-2)15(18)17-12-6-4-3-5-11(12)16/h3-9H,1-2H3,(H,17,18)
InChIKeySBWZRQSRNWBKRE-UHFFFAOYSA-N
XLogP3.10
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.28
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-3,4-dimethoxybenzamide?
The IUPAC name of N-(2-fluorophenyl)-3,4-dimethoxybenzamide (CID 774073) is N-(2-fluorophenyl)-3,4-dimethoxybenzamide.
What is the SMILES notation for N-(2-fluorophenyl)-3,4-dimethoxybenzamide?
The canonical SMILES for N-(2-fluorophenyl)-3,4-dimethoxybenzamide is COc1ccc(C(=O)Nc2ccccc2F)cc1OC.
What is the InChIKey of N-(2-fluorophenyl)-3,4-dimethoxybenzamide?
The InChIKey is SBWZRQSRNWBKRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FNO3/c1-19-13-8-7-10(9-14(13)20-2)15(18)17-12-6-4-3-5-11(12)16/h3-9H,1-2H3,(H,17,18).
What are the key properties of N-(2-fluorophenyl)-3,4-dimethoxybenzamide?
N-(2-fluorophenyl)-3,4-dimethoxybenzamide has a molecular weight of 275.28 g/mol, XLogP of 3.10, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)-3,4-dimethoxybenzamide is sourced from PubChem (CID 774073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).