2-[benzhydryl(methyl)amino]-N-(2,6-difluorophenyl)acetamide

C22H20F2N2O — CID 8730143

IUPAC2-[benzhydryl(methyl)amino]-N-(2,6-difluorophenyl)acetamide
SMILESCN(CC(=O)Nc1c(F)cccc1F)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H20F2N2O/c1-26(15-20(27)25-21-18(23)13-8-14-19(21)24)22(16-9-4-2-5-10-16)17-11-6-3-7-12-17/h2-14,22H,15H2,1H3,(H,25,27)
InChIKeyISWLYMXLEAZENV-UHFFFAOYSA-N
MW366.41 g/mol
LogP4.62
Rot. Bonds6

About 2-[benzhydryl(methyl)amino]-N-(2,6-difluorophenyl)acetamide

2-[benzhydryl(methyl)amino]-N-(2,6-difluorophenyl)acetamide (PubChem CID 8730143) has the molecular formula C22H20F2N2O and a molecular weight of 366.41 g/mol. Its IUPAC name is 2-[benzhydryl(methyl)amino]-N-(2,6-difluorophenyl)acetamide.

Molecular Properties

Compound Name2-[benzhydryl(methyl)amino]-N-(2,6-difluorophenyl)acetamide
PubChem CID8730143
Molecular FormulaC22H20F2N2O
Molecular Weight366.41 g/mol
Exact Mass366.15
IUPAC Name2-[benzhydryl(methyl)amino]-N-(2,6-difluorophenyl)acetamide
SMILESCN(CC(=O)Nc1c(F)cccc1F)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H20F2N2O/c1-26(15-20(27)25-21-18(23)13-8-14-19(21)24)22(16-9-4-2-5-10-16)17-11-6-3-7-12-17/h2-14,22H,15H2,1H3,(H,25,27)
InChIKeyISWLYMXLEAZENV-UHFFFAOYSA-N
XLogP4.62
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.41
LogP ≤ 54.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[benzhydryl(methyl)amino]-N-phenylacetamide
CID 8730173
2-[[(4-fluorophenyl)-phenylmethyl]-methylamino]-N-(2,4,6-trichlorophenyl)acetamide
CID 16609246
N-(2,6-dichloro-3-methylphenyl)-2-[[(R)-(4-fluorophenyl)-phenylmethyl]-methylamino]acetamide
CID 26249409
2-[benzhydryl(methyl)amino]-N-(2-propan-2-ylphenyl)acetamide
CID 8730199
2-[[2-(2,6-difluoroanilino)-2-oxoethyl]-ethylamino]-N,2-diphenylacetamide
CID 112804241
3-amino-N-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethyl-2-methyl-3-phenylpropanamide
CID 119680720
2-[[2-[benzhydryl(methyl)amino]acetyl]amino]acetamide
CID 8693314
2-[benzhydryl(methyl)amino]-N-(4-ethoxyphenyl)acetamide
CID 8730307
N-(4-bromo-2-methylphenyl)-2-[[(4-fluorophenyl)-phenylmethyl]-methylamino]acetamide
CID 16609224
2-[[2-(2,6-difluoroanilino)-2-oxoethyl]-methylamino]-N-(4-fluorophenyl)acetamide
CID 9253301
N-(2,6-difluorophenyl)-2-[(4-fluorophenyl)methyl-methylamino]acetamide
CID 2451655
N-(2,6-difluorophenyl)-2-[[(R)-(4-methylphenyl)-phenylmethyl]amino]acetamide
CID 9392689

Frequently Asked Questions

What is the IUPAC name of 2-[benzhydryl(methyl)amino]-N-(2,6-difluorophenyl)acetamide?
The IUPAC name of 2-[benzhydryl(methyl)amino]-N-(2,6-difluorophenyl)acetamide (CID 8730143) is 2-[benzhydryl(methyl)amino]-N-(2,6-difluorophenyl)acetamide.
What is the SMILES notation for 2-[benzhydryl(methyl)amino]-N-(2,6-difluorophenyl)acetamide?
The canonical SMILES for 2-[benzhydryl(methyl)amino]-N-(2,6-difluorophenyl)acetamide is CN(CC(=O)Nc1c(F)cccc1F)C(c1ccccc1)c1ccccc1.
What is the InChIKey of 2-[benzhydryl(methyl)amino]-N-(2,6-difluorophenyl)acetamide?
The InChIKey is ISWLYMXLEAZENV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20F2N2O/c1-26(15-20(27)25-21-18(23)13-8-14-19(21)24)22(16-9-4-2-5-10-16)17-11-6-3-7-12-17/h2-14,22H,15H2,1H3,(H,25,27).
What are the key properties of 2-[benzhydryl(methyl)amino]-N-(2,6-difluorophenyl)acetamide?
2-[benzhydryl(methyl)amino]-N-(2,6-difluorophenyl)acetamide has a molecular weight of 366.41 g/mol, XLogP of 4.62, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[benzhydryl(methyl)amino]-N-(2,6-difluorophenyl)acetamide is sourced from PubChem (CID 8730143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).