2-(4-fluorophenyl)-N-(3-methoxyphenyl)-2-methylpropanamide

C17H18FNO2 — CID 113197444

IUPAC2-(4-fluorophenyl)-N-(3-methoxyphenyl)-2-methylpropanamide
SMILESCOc1cccc(NC(=O)C(C)(C)c2ccc(F)cc2)c1
InChIInChI=1S/C17H18FNO2/c1-17(2,12-7-9-13(18)10-8-12)16(20)19-14-5-4-6-15(11-14)21-3/h4-11H,1-3H3,(H,19,20)
InChIKeyKBNVFAVRXUGPQV-UHFFFAOYSA-N
MW287.33 g/mol
LogP3.75
Rot. Bonds4

About 2-(4-fluorophenyl)-N-(3-methoxyphenyl)-2-methylpropanamide

2-(4-fluorophenyl)-N-(3-methoxyphenyl)-2-methylpropanamide (PubChem CID 113197444) has the molecular formula C17H18FNO2 and a molecular weight of 287.33 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-N-(3-methoxyphenyl)-2-methylpropanamide.

Molecular Properties

Compound Name2-(4-fluorophenyl)-N-(3-methoxyphenyl)-2-methylpropanamide
PubChem CID113197444
Molecular FormulaC17H18FNO2
Molecular Weight287.33 g/mol
Exact Mass287.13
IUPAC Name2-(4-fluorophenyl)-N-(3-methoxyphenyl)-2-methylpropanamide
SMILESCOc1cccc(NC(=O)C(C)(C)c2ccc(F)cc2)c1
InChIInChI=1S/C17H18FNO2/c1-17(2,12-7-9-13(18)10-8-12)16(20)19-14-5-4-6-15(11-14)21-3/h4-11H,1-3H3,(H,19,20)
InChIKeyKBNVFAVRXUGPQV-UHFFFAOYSA-N
XLogP3.75
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 ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,2-difluoro-2-(4-fluorophenyl)-N-(3-methoxyphenyl)acetamide
CID 48571112
N-(4-fluorophenyl)-2-(4-methoxyphenyl)-2-methylpropanamide
CID 110438737
N-(3-fluorophenyl)-N'-(3-methoxyphenyl)-2,2-dimethylpropanediamide
CID 108969376
N-(3-acetamidophenyl)-2-(4-methoxyphenyl)-2-methylpropanamide
CID 110438763
2-hydroxy-N-(3-methoxyphenyl)-2,2-diphenylacetamide
CID 828005
N-[3-(dimethylamino)phenyl]-2-(4-methoxyphenyl)-2-methylpropanamide
CID 110438804
1-N-(4-fluorophenyl)-3-N-(3-methoxyphenyl)benzene-1,3-dicarboxamide
CID 109057463
N-(4-fluorophenyl)-2-methyl-2-(4-methylphenyl)propanamide
CID 113198106
2-amino-2-ethyl-N-(3-methoxyphenyl)butanamide
CID 79809500
1-(3-methoxyphenyl)-3-[2-(4-methoxyphenyl)propan-2-yl]urea
CID 113216514
8-chloro-2,2,3,3,4,4,5,5,6,6,7,7,8,8-tetradecafluoro-N-(3-methoxyphenyl)octanamide
CID 4621112
2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-heptadecafluoro-N-(3-methoxyphenyl)nonanamide
CID 3510887

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-N-(3-methoxyphenyl)-2-methylpropanamide?
The IUPAC name of 2-(4-fluorophenyl)-N-(3-methoxyphenyl)-2-methylpropanamide (CID 113197444) is 2-(4-fluorophenyl)-N-(3-methoxyphenyl)-2-methylpropanamide.
What is the SMILES notation for 2-(4-fluorophenyl)-N-(3-methoxyphenyl)-2-methylpropanamide?
The canonical SMILES for 2-(4-fluorophenyl)-N-(3-methoxyphenyl)-2-methylpropanamide is COc1cccc(NC(=O)C(C)(C)c2ccc(F)cc2)c1.
What is the InChIKey of 2-(4-fluorophenyl)-N-(3-methoxyphenyl)-2-methylpropanamide?
The InChIKey is KBNVFAVRXUGPQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18FNO2/c1-17(2,12-7-9-13(18)10-8-12)16(20)19-14-5-4-6-15(11-14)21-3/h4-11H,1-3H3,(H,19,20).
What are the key properties of 2-(4-fluorophenyl)-N-(3-methoxyphenyl)-2-methylpropanamide?
2-(4-fluorophenyl)-N-(3-methoxyphenyl)-2-methylpropanamide has a molecular weight of 287.33 g/mol, XLogP of 3.75, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-N-(3-methoxyphenyl)-2-methylpropanamide is sourced from PubChem (CID 113197444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).