N-(2,3-dimethylphenyl)-2-[[2-(2-fluorophenyl)-2-hydroxyethyl]-methylamino]acetamide

C19H23FN2O2 — CID 110887628

IUPACN-(2,3-dimethylphenyl)-2-[[2-(2-fluorophenyl)-2-hydroxyethyl]-methylamino]acetamide
SMILESCc1cccc(NC(=O)CN(C)CC(O)c2ccccc2F)c1C
InChIInChI=1S/C19H23FN2O2/c1-13-7-6-10-17(14(13)2)21-19(24)12-22(3)11-18(23)15-8-4-5-9-16(15)20/h4-10,18,23H,11-12H2,1-3H3,(H,21,24)
InChIKeyNSGVDAMIKGKOAC-UHFFFAOYSA-N
MW330.40 g/mol
LogP3.05
Rot. Bonds6

About N-(2,3-dimethylphenyl)-2-[[2-(2-fluorophenyl)-2-hydroxyethyl]-methylamino]acetamide

N-(2,3-dimethylphenyl)-2-[[2-(2-fluorophenyl)-2-hydroxyethyl]-methylamino]acetamide (PubChem CID 110887628) has the molecular formula C19H23FN2O2 and a molecular weight of 330.40 g/mol. Its IUPAC name is N-(2,3-dimethylphenyl)-2-[[2-(2-fluorophenyl)-2-hydroxyethyl]-methylamino]acetamide.

Molecular Properties

Compound NameN-(2,3-dimethylphenyl)-2-[[2-(2-fluorophenyl)-2-hydroxyethyl]-methylamino]acetamide
PubChem CID110887628
Molecular FormulaC19H23FN2O2
Molecular Weight330.40 g/mol
Exact Mass330.17
IUPAC NameN-(2,3-dimethylphenyl)-2-[[2-(2-fluorophenyl)-2-hydroxyethyl]-methylamino]acetamide
SMILESCc1cccc(NC(=O)CN(C)CC(O)c2ccccc2F)c1C
InChIInChI=1S/C19H23FN2O2/c1-13-7-6-10-17(14(13)2)21-19(24)12-22(3)11-18(23)15-8-4-5-9-16(15)20/h4-10,18,23H,11-12H2,1-3H3,(H,21,24)
InChIKeyNSGVDAMIKGKOAC-UHFFFAOYSA-N
XLogP3.05
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.40
LogP ≤ 53.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[2-(2,5-difluorophenyl)-2-hydroxyethyl]-methylamino]-N-(2,6-dimethylphenyl)acetamide
CID 110898244
2-[[2-(2,6-difluorophenyl)-2-hydroxyethyl]-methylamino]-N-(2-ethylphenyl)acetamide
CID 110898303
N-(3-ethynylphenyl)-2-[[2-(2-fluorophenyl)-2-hydroxyethyl]-methylamino]acetamide
CID 110898649
N-(4-chloro-2-fluorophenyl)-2-[[2-(2,3-dimethylanilino)-2-oxoethyl]-methylamino]acetamide
CID 9287978
N-[2-(2,3-dimethylanilino)-2-oxoethyl]-2-(2-fluorophenyl)-N-methylacetamide
CID 8503634
2-[[(1R)-1-(2-chlorophenyl)ethyl]-methylamino]-N-(2,3-dimethylphenyl)acetamide
CID 9287667
2-[acetyl(2-methylpropyl)amino]-N-(2,3-dimethylphenyl)acetamide
CID 113158912
2-[[2-(5-chloro-2-methylanilino)-2-oxoethyl]-methylamino]-N-(2,3-dimethylphenyl)acetamide
CID 9287854
N-(2,3-dimethylphenyl)-2-[methyl-[2-(methylcarbamoylamino)-2-oxoethyl]amino]acetamide
CID 9287446
2-[(2-bromophenyl)methyl-methylamino]-N-(2,3-dimethylphenyl)acetamide
CID 27204661
N-(2,3-dimethylphenyl)-2-[methyl-[2-[methyl-[(1R)-1-phenylethyl]amino]-2-oxoethyl]amino]acetamide
CID 9348322
2-[(2,6-dichlorophenyl)methyl-methylamino]-N-(2,3-dimethylphenyl)acetamide
CID 9287814

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylphenyl)-2-[[2-(2-fluorophenyl)-2-hydroxyethyl]-methylamino]acetamide?
The IUPAC name of N-(2,3-dimethylphenyl)-2-[[2-(2-fluorophenyl)-2-hydroxyethyl]-methylamino]acetamide (CID 110887628) is N-(2,3-dimethylphenyl)-2-[[2-(2-fluorophenyl)-2-hydroxyethyl]-methylamino]acetamide.
What is the SMILES notation for N-(2,3-dimethylphenyl)-2-[[2-(2-fluorophenyl)-2-hydroxyethyl]-methylamino]acetamide?
The canonical SMILES for N-(2,3-dimethylphenyl)-2-[[2-(2-fluorophenyl)-2-hydroxyethyl]-methylamino]acetamide is Cc1cccc(NC(=O)CN(C)CC(O)c2ccccc2F)c1C.
What is the InChIKey of N-(2,3-dimethylphenyl)-2-[[2-(2-fluorophenyl)-2-hydroxyethyl]-methylamino]acetamide?
The InChIKey is NSGVDAMIKGKOAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23FN2O2/c1-13-7-6-10-17(14(13)2)21-19(24)12-22(3)11-18(23)15-8-4-5-9-16(15)20/h4-10,18,23H,11-12H2,1-3H3,(H,21,24).
What are the key properties of N-(2,3-dimethylphenyl)-2-[[2-(2-fluorophenyl)-2-hydroxyethyl]-methylamino]acetamide?
N-(2,3-dimethylphenyl)-2-[[2-(2-fluorophenyl)-2-hydroxyethyl]-methylamino]acetamide has a molecular weight of 330.40 g/mol, XLogP of 3.05, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylphenyl)-2-[[2-(2-fluorophenyl)-2-hydroxyethyl]-methylamino]acetamide is sourced from PubChem (CID 110887628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).