2-fluoro-4-methoxy-N-[(5-methylfuran-2-yl)methyl]benzamide

C14H14FNO3 — CID 102882068

IUPAC2-fluoro-4-methoxy-N-[(5-methylfuran-2-yl)methyl]benzamide
SMILESCOc1ccc(C(=O)NCc2ccc(C)o2)c(F)c1
InChIInChI=1S/C14H14FNO3/c1-9-3-4-11(19-9)8-16-14(17)12-6-5-10(18-2)7-13(12)15/h3-7H,8H2,1-2H3,(H,16,17)
InChIKeyCFTXFSDFDKRHCD-UHFFFAOYSA-N
MW263.27 g/mol
LogP2.67
Rot. Bonds4

About 2-fluoro-4-methoxy-N-[(5-methylfuran-2-yl)methyl]benzamide

2-fluoro-4-methoxy-N-[(5-methylfuran-2-yl)methyl]benzamide (PubChem CID 102882068) has the molecular formula C14H14FNO3 and a molecular weight of 263.27 g/mol. Its IUPAC name is 2-fluoro-4-methoxy-N-[(5-methylfuran-2-yl)methyl]benzamide.

Molecular Properties

Compound Name2-fluoro-4-methoxy-N-[(5-methylfuran-2-yl)methyl]benzamide
PubChem CID102882068
Molecular FormulaC14H14FNO3
Molecular Weight263.27 g/mol
Exact Mass263.10
IUPAC Name2-fluoro-4-methoxy-N-[(5-methylfuran-2-yl)methyl]benzamide
SMILESCOc1ccc(C(=O)NCc2ccc(C)o2)c(F)c1
InChIInChI=1S/C14H14FNO3/c1-9-3-4-11(19-9)8-16-14(17)12-6-5-10(18-2)7-13(12)15/h3-7H,8H2,1-2H3,(H,16,17)
InChIKeyCFTXFSDFDKRHCD-UHFFFAOYSA-N
XLogP2.67
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.27
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-fluoro-N-[(4-fluorophenyl)methyl]-4-methoxybenzamide
CID 30691396
2-fluoro-4-methoxy-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]benzamide
CID 102882104
4-bromo-2-methoxy-N-[(5-methylfuran-2-yl)methyl]benzamide
CID 115369253
2-methoxy-N-[(5-methylfuran-2-yl)methyl]benzamide
CID 110731629
N-(2-chloroethyl)-2-fluoro-4-methoxybenzamide
CID 102883572
ethyl 2-[(2-fluoro-4-methoxybenzoyl)amino]acetate
CID 87037221
2-fluoro-4-methoxy-N-(oxan-4-ylmethyl)benzamide
CID 113228962
2-fluoro-4-methoxy-N-[(4-methyl-3-pyridinyl)methyl]benzamide
CID 102882143
N-but-2-ynyl-2-fluoro-4-methoxybenzamide
CID 103868606
methyl N-[4-[[(2-fluoro-4-methoxybenzoyl)amino]methyl]phenyl]carbamate
CID 87019008
N-[(1,5-dimethylpyrazol-4-yl)methyl]-2-fluoro-4-methoxybenzamide
CID 103860981
4-fluoro-3-methyl-N-[(5-methylfuran-2-yl)methyl]benzamide
CID 63213507

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-4-methoxy-N-[(5-methylfuran-2-yl)methyl]benzamide?
The IUPAC name of 2-fluoro-4-methoxy-N-[(5-methylfuran-2-yl)methyl]benzamide (CID 102882068) is 2-fluoro-4-methoxy-N-[(5-methylfuran-2-yl)methyl]benzamide.
What is the SMILES notation for 2-fluoro-4-methoxy-N-[(5-methylfuran-2-yl)methyl]benzamide?
The canonical SMILES for 2-fluoro-4-methoxy-N-[(5-methylfuran-2-yl)methyl]benzamide is COc1ccc(C(=O)NCc2ccc(C)o2)c(F)c1.
What is the InChIKey of 2-fluoro-4-methoxy-N-[(5-methylfuran-2-yl)methyl]benzamide?
The InChIKey is CFTXFSDFDKRHCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FNO3/c1-9-3-4-11(19-9)8-16-14(17)12-6-5-10(18-2)7-13(12)15/h3-7H,8H2,1-2H3,(H,16,17).
What are the key properties of 2-fluoro-4-methoxy-N-[(5-methylfuran-2-yl)methyl]benzamide?
2-fluoro-4-methoxy-N-[(5-methylfuran-2-yl)methyl]benzamide has a molecular weight of 263.27 g/mol, XLogP of 2.67, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-4-methoxy-N-[(5-methylfuran-2-yl)methyl]benzamide is sourced from PubChem (CID 102882068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).