2-fluoro-4-methoxy-N-(2-propan-2-ylphenyl)benzamide

C17H18FNO2 — CID 103602982

IUPAC2-fluoro-4-methoxy-N-(2-propan-2-ylphenyl)benzamide
SMILESCOc1ccc(C(=O)Nc2ccccc2C(C)C)c(F)c1
InChIInChI=1S/C17H18FNO2/c1-11(2)13-6-4-5-7-16(13)19-17(20)14-9-8-12(21-3)10-15(14)18/h4-11H,1-3H3,(H,19,20)
InChIKeyLBYKPJBUEDRJJW-UHFFFAOYSA-N
MW287.33 g/mol
LogP4.21
Rot. Bonds4

About 2-fluoro-4-methoxy-N-(2-propan-2-ylphenyl)benzamide

2-fluoro-4-methoxy-N-(2-propan-2-ylphenyl)benzamide (PubChem CID 103602982) has the molecular formula C17H18FNO2 and a molecular weight of 287.33 g/mol. Its IUPAC name is 2-fluoro-4-methoxy-N-(2-propan-2-ylphenyl)benzamide.

Molecular Properties

Compound Name2-fluoro-4-methoxy-N-(2-propan-2-ylphenyl)benzamide
PubChem CID103602982
Molecular FormulaC17H18FNO2
Molecular Weight287.33 g/mol
Exact Mass287.13
IUPAC Name2-fluoro-4-methoxy-N-(2-propan-2-ylphenyl)benzamide
SMILESCOc1ccc(C(=O)Nc2ccccc2C(C)C)c(F)c1
InChIInChI=1S/C17H18FNO2/c1-11(2)13-6-4-5-7-16(13)19-17(20)14-9-8-12(21-3)10-15(14)18/h4-11H,1-3H3,(H,19,20)
InChIKeyLBYKPJBUEDRJJW-UHFFFAOYSA-N
XLogP4.21
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.33
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-4-methoxy-N-(2-propan-2-ylphenyl)benzamide
CID 80503097
5-amino-2,4-difluoro-N-(2-propan-2-ylphenyl)benzamide
CID 61092146
N-[2-(1-bromoethyl)phenyl]-2-hydroxy-4-methoxybenzamide
CID 114315449
N-(2-bromo-3-methylphenyl)-2-fluoro-4-methoxybenzamide
CID 104870934
6-methoxy-2-oxo-N-(2-propan-2-ylphenyl)chromene-3-carboxamide
CID 19207085
N-[1-(2-chlorophenyl)ethyl]-2-fluoro-4-methoxybenzamide
CID 86906510
ethyl N-[3-[(2-fluoro-4-methoxybenzoyl)amino]-2-methylphenyl]carbamate
CID 87043158
1-N-(4-methoxyphenyl)-4-N-(2-propan-2-ylphenyl)benzene-1,4-dicarboxamide
CID 109049815
N-[2-(1-aminoethyl)phenyl]-2,4-difluorobenzamide
CID 16785051
2-fluoro-N-(4-fluoro-2-iodophenyl)-4-methoxybenzamide
CID 103737180
N-(2-amino-4-hydroxyphenyl)-2-fluoro-4-methoxybenzamide
CID 107697209
N-(2-amino-4-methylphenyl)-2-fluoro-4-methoxybenzamide
CID 102881866

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-4-methoxy-N-(2-propan-2-ylphenyl)benzamide?
The IUPAC name of 2-fluoro-4-methoxy-N-(2-propan-2-ylphenyl)benzamide (CID 103602982) is 2-fluoro-4-methoxy-N-(2-propan-2-ylphenyl)benzamide.
What is the SMILES notation for 2-fluoro-4-methoxy-N-(2-propan-2-ylphenyl)benzamide?
The canonical SMILES for 2-fluoro-4-methoxy-N-(2-propan-2-ylphenyl)benzamide is COc1ccc(C(=O)Nc2ccccc2C(C)C)c(F)c1.
What is the InChIKey of 2-fluoro-4-methoxy-N-(2-propan-2-ylphenyl)benzamide?
The InChIKey is LBYKPJBUEDRJJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18FNO2/c1-11(2)13-6-4-5-7-16(13)19-17(20)14-9-8-12(21-3)10-15(14)18/h4-11H,1-3H3,(H,19,20).
What are the key properties of 2-fluoro-4-methoxy-N-(2-propan-2-ylphenyl)benzamide?
2-fluoro-4-methoxy-N-(2-propan-2-ylphenyl)benzamide has a molecular weight of 287.33 g/mol, XLogP of 4.21, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-4-methoxy-N-(2-propan-2-ylphenyl)benzamide is sourced from PubChem (CID 103602982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).