N-(3,4-difluorophenyl)-2-(2-methoxyphenyl)-2-methylpropanamide

C17H17F2NO2 — CID 110438888

IUPACN-(3,4-difluorophenyl)-2-(2-methoxyphenyl)-2-methylpropanamide
SMILESCOc1ccccc1C(C)(C)C(=O)Nc1ccc(F)c(F)c1
InChIInChI=1S/C17H17F2NO2/c1-17(2,12-6-4-5-7-15(12)22-3)16(21)20-11-8-9-13(18)14(19)10-11/h4-10H,1-3H3,(H,20,21)
InChIKeyGSFIOJQIMTZGAV-UHFFFAOYSA-N
MW305.32 g/mol
LogP3.89
Rot. Bonds4

About N-(3,4-difluorophenyl)-2-(2-methoxyphenyl)-2-methylpropanamide

N-(3,4-difluorophenyl)-2-(2-methoxyphenyl)-2-methylpropanamide (PubChem CID 110438888) has the molecular formula C17H17F2NO2 and a molecular weight of 305.32 g/mol. Its IUPAC name is N-(3,4-difluorophenyl)-2-(2-methoxyphenyl)-2-methylpropanamide.

Molecular Properties

Compound NameN-(3,4-difluorophenyl)-2-(2-methoxyphenyl)-2-methylpropanamide
PubChem CID110438888
Molecular FormulaC17H17F2NO2
Molecular Weight305.32 g/mol
Exact Mass305.12
IUPAC NameN-(3,4-difluorophenyl)-2-(2-methoxyphenyl)-2-methylpropanamide
SMILESCOc1ccccc1C(C)(C)C(=O)Nc1ccc(F)c(F)c1
InChIInChI=1S/C17H17F2NO2/c1-17(2,12-6-4-5-7-15(12)22-3)16(21)20-11-8-9-13(18)14(19)10-11/h4-10H,1-3H3,(H,20,21)
InChIKeyGSFIOJQIMTZGAV-UHFFFAOYSA-N
XLogP3.89
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.32
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3,4-dimethoxyphenyl)-2-(2-methoxyphenyl)-2-methylpropanamide
CID 110438838
N-(3-chloro-4-methoxyphenyl)-2-(2-methoxyphenyl)-2-methylpropanamide
CID 110438825
N-(2,6-difluorophenyl)-2-(2-methoxyphenyl)-2-methylpropanamide
CID 110438890
N-[3-(dimethylamino)phenyl]-2-(2-methoxyphenyl)-2-methylpropanamide
CID 110438885
N-(3,4-difluorophenyl)-2-(1H-indol-3-yl)-2-methylpropanamide
CID 113209071
N,N'-bis(3,4-difluorophenyl)-2,2-dimethylpropanediamide
CID 108970184
N-(2-tert-butylphenyl)-N'-(3,4-difluorophenyl)-2,2-dimethylpropanediamide
CID 108968655
2-bromo-N-(3-fluoro-4-methoxyphenyl)-2-methylpropanamide
CID 114327553
2-amino-N-(4-fluoro-3-methoxyphenyl)-2-methylpropanamide
CID 114839711
2-(2-methoxyphenyl)-2-methyl-N-(1,3-thiazol-2-yl)propanamide
CID 110439598
2-amino-N-[3-fluoro-4-(2-methoxyphenoxy)phenyl]-2-methylpentanamide
CID 119751481
1-N-(3,4-difluorophenyl)-3-N-(2-methoxyphenyl)benzene-1,3-dicarboxamide
CID 109057618

Frequently Asked Questions

What is the IUPAC name of N-(3,4-difluorophenyl)-2-(2-methoxyphenyl)-2-methylpropanamide?
The IUPAC name of N-(3,4-difluorophenyl)-2-(2-methoxyphenyl)-2-methylpropanamide (CID 110438888) is N-(3,4-difluorophenyl)-2-(2-methoxyphenyl)-2-methylpropanamide.
What is the SMILES notation for N-(3,4-difluorophenyl)-2-(2-methoxyphenyl)-2-methylpropanamide?
The canonical SMILES for N-(3,4-difluorophenyl)-2-(2-methoxyphenyl)-2-methylpropanamide is COc1ccccc1C(C)(C)C(=O)Nc1ccc(F)c(F)c1.
What is the InChIKey of N-(3,4-difluorophenyl)-2-(2-methoxyphenyl)-2-methylpropanamide?
The InChIKey is GSFIOJQIMTZGAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17F2NO2/c1-17(2,12-6-4-5-7-15(12)22-3)16(21)20-11-8-9-13(18)14(19)10-11/h4-10H,1-3H3,(H,20,21).
What are the key properties of N-(3,4-difluorophenyl)-2-(2-methoxyphenyl)-2-methylpropanamide?
N-(3,4-difluorophenyl)-2-(2-methoxyphenyl)-2-methylpropanamide has a molecular weight of 305.32 g/mol, XLogP of 3.89, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-difluorophenyl)-2-(2-methoxyphenyl)-2-methylpropanamide is sourced from PubChem (CID 110438888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).