N-(5-fluoro-2-methylphenyl)-4-(4-methoxyphenyl)butanamide

C18H20FNO2 — CID 798892

IUPACN-(5-fluoro-2-methylphenyl)-4-(4-methoxyphenyl)butanamide
SMILESCOc1ccc(CCCC(=O)Nc2cc(F)ccc2C)cc1
InChIInChI=1S/C18H20FNO2/c1-13-6-9-15(19)12-17(13)20-18(21)5-3-4-14-7-10-16(22-2)11-8-14/h6-12H,3-5H2,1-2H3,(H,20,21)
InChIKeyHOOLAJOWMOOLIV-UHFFFAOYSA-N
MW301.36 g/mol
LogP4.10
Rot. Bonds6

About N-(5-fluoro-2-methylphenyl)-4-(4-methoxyphenyl)butanamide

N-(5-fluoro-2-methylphenyl)-4-(4-methoxyphenyl)butanamide (PubChem CID 798892) has the molecular formula C18H20FNO2 and a molecular weight of 301.36 g/mol. Its IUPAC name is N-(5-fluoro-2-methylphenyl)-4-(4-methoxyphenyl)butanamide.

Molecular Properties

Compound NameN-(5-fluoro-2-methylphenyl)-4-(4-methoxyphenyl)butanamide
PubChem CID798892
Molecular FormulaC18H20FNO2
Molecular Weight301.36 g/mol
Exact Mass301.15
IUPAC NameN-(5-fluoro-2-methylphenyl)-4-(4-methoxyphenyl)butanamide
SMILESCOc1ccc(CCCC(=O)Nc2cc(F)ccc2C)cc1
InChIInChI=1S/C18H20FNO2/c1-13-6-9-15(19)12-17(13)20-18(21)5-3-4-14-7-10-16(22-2)11-8-14/h6-12H,3-5H2,1-2H3,(H,20,21)
InChIKeyHOOLAJOWMOOLIV-UHFFFAOYSA-N
XLogP4.10
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.36
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(4-fluorophenyl)-N-[2-(4-methoxyphenyl)ethyl]butanamide
CID 110297665
N,N'-bis(5-methoxy-2-methylphenyl)decanediamide
CID 10670784
[2-(5-fluoro-2-methylanilino)-2-oxoethyl] 4-methoxybenzoate
CID 2510209
N-(4-fluoro-2-methylphenyl)-2-(4-methoxyphenyl)acetamide
CID 2676308
4-amino-N-(5-fluoro-2-methylphenyl)butanamide;hydrochloride
CID 119263253
N-[2-(4-fluorophenyl)ethyl]-5-(4-methoxyphenyl)pentanamide
CID 110297832
N-(4-methoxy-2-methylphenyl)-3-(4-methoxyphenyl)propanamide
CID 17173046
1-(5-fluoro-2-methylphenyl)-3-(4-methoxyphenyl)urea
CID 970666
N-(5-chloro-2-methylphenyl)-3-[2-(4-methoxyphenyl)ethylamino]propanamide
CID 109025931
3-[acetyl-[2-(4-methoxyphenyl)ethyl]amino]-N-(2,5-dimethylphenyl)propanamide
CID 113121514
2-(4-ethylphenoxy)-N-(5-fluoro-2-methylphenyl)acetamide
CID 804157
N-(2-chlorophenyl)-4-(4-methoxyphenyl)butanamide
CID 48980503

Frequently Asked Questions

What is the IUPAC name of N-(5-fluoro-2-methylphenyl)-4-(4-methoxyphenyl)butanamide?
The IUPAC name of N-(5-fluoro-2-methylphenyl)-4-(4-methoxyphenyl)butanamide (CID 798892) is N-(5-fluoro-2-methylphenyl)-4-(4-methoxyphenyl)butanamide.
What is the SMILES notation for N-(5-fluoro-2-methylphenyl)-4-(4-methoxyphenyl)butanamide?
The canonical SMILES for N-(5-fluoro-2-methylphenyl)-4-(4-methoxyphenyl)butanamide is COc1ccc(CCCC(=O)Nc2cc(F)ccc2C)cc1.
What is the InChIKey of N-(5-fluoro-2-methylphenyl)-4-(4-methoxyphenyl)butanamide?
The InChIKey is HOOLAJOWMOOLIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20FNO2/c1-13-6-9-15(19)12-17(13)20-18(21)5-3-4-14-7-10-16(22-2)11-8-14/h6-12H,3-5H2,1-2H3,(H,20,21).
What are the key properties of N-(5-fluoro-2-methylphenyl)-4-(4-methoxyphenyl)butanamide?
N-(5-fluoro-2-methylphenyl)-4-(4-methoxyphenyl)butanamide has a molecular weight of 301.36 g/mol, XLogP of 4.10, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-fluoro-2-methylphenyl)-4-(4-methoxyphenyl)butanamide is sourced from PubChem (CID 798892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).