2-fluoro-N-(3-methoxy-2,4-dimethylphenyl)-5-methylbenzamide

C17H18FNO2 — CID 62509266

IUPAC2-fluoro-N-(3-methoxy-2,4-dimethylphenyl)-5-methylbenzamide
SMILESCOc1c(C)ccc(NC(=O)c2cc(C)ccc2F)c1C
InChIInChI=1S/C17H18FNO2/c1-10-5-7-14(18)13(9-10)17(20)19-15-8-6-11(2)16(21-4)12(15)3/h5-9H,1-4H3,(H,19,20)
InChIKeyIFAAYLQWZUUWLR-UHFFFAOYSA-N
MW287.33 g/mol
LogP4.01
Rot. Bonds3

About 2-fluoro-N-(3-methoxy-2,4-dimethylphenyl)-5-methylbenzamide

2-fluoro-N-(3-methoxy-2,4-dimethylphenyl)-5-methylbenzamide (PubChem CID 62509266) has the molecular formula C17H18FNO2 and a molecular weight of 287.33 g/mol. Its IUPAC name is 2-fluoro-N-(3-methoxy-2,4-dimethylphenyl)-5-methylbenzamide.

Molecular Properties

Compound Name2-fluoro-N-(3-methoxy-2,4-dimethylphenyl)-5-methylbenzamide
PubChem CID62509266
Molecular FormulaC17H18FNO2
Molecular Weight287.33 g/mol
Exact Mass287.13
IUPAC Name2-fluoro-N-(3-methoxy-2,4-dimethylphenyl)-5-methylbenzamide
SMILESCOc1c(C)ccc(NC(=O)c2cc(C)ccc2F)c1C
InChIInChI=1S/C17H18FNO2/c1-10-5-7-14(18)13(9-10)17(20)19-15-8-6-11(2)16(21-4)12(15)3/h5-9H,1-4H3,(H,19,20)
InChIKeyIFAAYLQWZUUWLR-UHFFFAOYSA-N
XLogP4.01
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.33
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-4-chloro-N-(3-methoxy-2,4-dimethylphenyl)benzamide
CID 63110657
2-[(2-fluoro-5-methylbenzoyl)amino]-5-methylbenzoic acid
CID 62515827
2-fluoro-N-(3-hydroxy-2-methylphenyl)-5-methylbenzamide
CID 64794363
2-fluoro-N-(4-iodo-2-methylphenyl)-5-methylbenzamide
CID 55083380
N-(4-chloro-2-fluorophenyl)-2-fluoro-5-methylbenzamide
CID 55083427
2,3-difluoro-N-(3-methoxy-2,4-dimethylphenyl)pyridine-4-carboxamide
CID 105380636
3-[(2-fluoro-5-methylbenzoyl)amino]-4-methylbenzoic acid
CID 62514248
5-amino-2-fluoro-N-(2-methoxy-4-methylphenyl)benzamide
CID 61117897
N-(5-bromo-2-methoxyphenyl)-2-fluoro-5-methylbenzamide
CID 62515870
N-(4-amino-2-chlorophenyl)-2-fluoro-5-methylbenzamide
CID 62515470
N-(2,4-dimethylphenyl)-2-fluoro-5-sulfanylbenzamide
CID 107020951
2-[(2-fluoro-5-methylbenzoyl)amino]-5-hydroxybenzoic acid
CID 62514253

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-(3-methoxy-2,4-dimethylphenyl)-5-methylbenzamide?
The IUPAC name of 2-fluoro-N-(3-methoxy-2,4-dimethylphenyl)-5-methylbenzamide (CID 62509266) is 2-fluoro-N-(3-methoxy-2,4-dimethylphenyl)-5-methylbenzamide.
What is the SMILES notation for 2-fluoro-N-(3-methoxy-2,4-dimethylphenyl)-5-methylbenzamide?
The canonical SMILES for 2-fluoro-N-(3-methoxy-2,4-dimethylphenyl)-5-methylbenzamide is COc1c(C)ccc(NC(=O)c2cc(C)ccc2F)c1C.
What is the InChIKey of 2-fluoro-N-(3-methoxy-2,4-dimethylphenyl)-5-methylbenzamide?
The InChIKey is IFAAYLQWZUUWLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18FNO2/c1-10-5-7-14(18)13(9-10)17(20)19-15-8-6-11(2)16(21-4)12(15)3/h5-9H,1-4H3,(H,19,20).
What are the key properties of 2-fluoro-N-(3-methoxy-2,4-dimethylphenyl)-5-methylbenzamide?
2-fluoro-N-(3-methoxy-2,4-dimethylphenyl)-5-methylbenzamide has a molecular weight of 287.33 g/mol, XLogP of 4.01, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-(3-methoxy-2,4-dimethylphenyl)-5-methylbenzamide is sourced from PubChem (CID 62509266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).