2,2-difluoro-N-[(R)-(2-methoxyphenyl)-(4-methoxyphenyl)methyl]acetamide

C17H17F2NO3 — CID 100703367

IUPAC2,2-difluoro-N-[(R)-(2-methoxyphenyl)-(4-methoxyphenyl)methyl]acetamide
SMILESCOc1ccc([C@@H](NC(=O)C(F)F)c2ccccc2OC)cc1
InChIInChI=1S/C17H17F2NO3/c1-22-12-9-7-11(8-10-12)15(20-17(21)16(18)19)13-5-3-4-6-14(13)23-2/h3-10,15-16H,1-2H3,(H,20,21)/t15-/m1/s1
InChIKeyLCPLWFSFXDPJKU-OAHLLOKOSA-N
MW321.32 g/mol
LogP3.17
Rot. Bonds6

About 2,2-difluoro-N-[(R)-(2-methoxyphenyl)-(4-methoxyphenyl)methyl]acetamide

2,2-difluoro-N-[(R)-(2-methoxyphenyl)-(4-methoxyphenyl)methyl]acetamide (PubChem CID 100703367) has the molecular formula C17H17F2NO3 and a molecular weight of 321.32 g/mol. Its IUPAC name is 2,2-difluoro-N-[(R)-(2-methoxyphenyl)-(4-methoxyphenyl)methyl]acetamide.

Molecular Properties

Compound Name2,2-difluoro-N-[(R)-(2-methoxyphenyl)-(4-methoxyphenyl)methyl]acetamide
PubChem CID100703367
Molecular FormulaC17H17F2NO3
Molecular Weight321.32 g/mol
Exact Mass321.12
IUPAC Name2,2-difluoro-N-[(R)-(2-methoxyphenyl)-(4-methoxyphenyl)methyl]acetamide
SMILESCOc1ccc([C@@H](NC(=O)C(F)F)c2ccccc2OC)cc1
InChIInChI=1S/C17H17F2NO3/c1-22-12-9-7-11(8-10-12)15(20-17(21)16(18)19)13-5-3-4-6-14(13)23-2/h3-10,15-16H,1-2H3,(H,20,21)/t15-/m1/s1
InChIKeyLCPLWFSFXDPJKU-OAHLLOKOSA-N
XLogP3.17
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.32
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[bis(2-methoxyphenyl)methyl]-2-(4-methoxyphenyl)propanamide
CID 175079399
N-[(S)-(2-methoxyphenyl)-(4-methoxyphenyl)methyl]-2-(methylamino)acetamide
CID 129432320
N-[bis(2-methoxyphenyl)methyl]-2-(4-fluorophenyl)propanamide
CID 175348426
(2S)-N-[bis(2-methoxyphenyl)methyl]-2-(4-fluorophenyl)propanamide
CID 166439731
N-[(4-methoxyphenyl)-phenylmethyl]-2-methylpropanamide
CID 46419913
(2R)-N-[bis(2-methoxyphenyl)methyl]-2-(3-methoxyphenyl)propanamide
CID 175077075
2,2-difluoro-N-[(S)-(4-methoxyphenyl)-phenylmethyl]-2-phenylacetamide
CID 51950712
N-[(4-fluorophenyl)-phenylmethyl]-2-(4-methoxyphenyl)sulfanylpropanamide
CID 60506189
N-[(2,4-dimethoxyphenyl)-(4-methoxyphenyl)methyl]prop-2-enamide
CID 139017490
N-[(S)-2,3-dihydro-1-benzofuran-5-yl-(4-methoxyphenyl)methyl]-2,2-difluoroacetamide
CID 100703606
2-(2-methoxyphenyl)-N-[(1R)-1-(4-methoxyphenyl)ethyl]acetamide
CID 40636202
N-[(R)-(2-methoxyphenyl)-(4-propan-2-ylphenyl)methyl]cyclopropanecarboxamide
CID 171097068

Frequently Asked Questions

What is the IUPAC name of 2,2-difluoro-N-[(R)-(2-methoxyphenyl)-(4-methoxyphenyl)methyl]acetamide?
The IUPAC name of 2,2-difluoro-N-[(R)-(2-methoxyphenyl)-(4-methoxyphenyl)methyl]acetamide (CID 100703367) is 2,2-difluoro-N-[(R)-(2-methoxyphenyl)-(4-methoxyphenyl)methyl]acetamide.
What is the SMILES notation for 2,2-difluoro-N-[(R)-(2-methoxyphenyl)-(4-methoxyphenyl)methyl]acetamide?
The canonical SMILES for 2,2-difluoro-N-[(R)-(2-methoxyphenyl)-(4-methoxyphenyl)methyl]acetamide is COc1ccc([C@@H](NC(=O)C(F)F)c2ccccc2OC)cc1.
What is the InChIKey of 2,2-difluoro-N-[(R)-(2-methoxyphenyl)-(4-methoxyphenyl)methyl]acetamide?
The InChIKey is LCPLWFSFXDPJKU-OAHLLOKOSA-N. The full InChI is InChI=1S/C17H17F2NO3/c1-22-12-9-7-11(8-10-12)15(20-17(21)16(18)19)13-5-3-4-6-14(13)23-2/h3-10,15-16H,1-2H3,(H,20,21)/t15-/m1/s1.
What are the key properties of 2,2-difluoro-N-[(R)-(2-methoxyphenyl)-(4-methoxyphenyl)methyl]acetamide?
2,2-difluoro-N-[(R)-(2-methoxyphenyl)-(4-methoxyphenyl)methyl]acetamide has a molecular weight of 321.32 g/mol, XLogP of 3.17, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-N-[(R)-(2-methoxyphenyl)-(4-methoxyphenyl)methyl]acetamide is sourced from PubChem (CID 100703367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).