N-(2,3-dimethylphenyl)-2-[(1-hydroxy-2-methylpropan-2-yl)-methylamino]acetamide

C15H24N2O2 — CID 115637950

IUPACN-(2,3-dimethylphenyl)-2-[(1-hydroxy-2-methylpropan-2-yl)-methylamino]acetamide
SMILESCc1cccc(NC(=O)CN(C)C(C)(C)CO)c1C
InChIInChI=1S/C15H24N2O2/c1-11-7-6-8-13(12(11)2)16-14(19)9-17(5)15(3,4)10-18/h6-8,18H,9-10H2,1-5H3,(H,16,19)
InChIKeyIFGCSPKWHOJYEV-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.94
Rot. Bonds5

About N-(2,3-dimethylphenyl)-2-[(1-hydroxy-2-methylpropan-2-yl)-methylamino]acetamide

N-(2,3-dimethylphenyl)-2-[(1-hydroxy-2-methylpropan-2-yl)-methylamino]acetamide (PubChem CID 115637950) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is N-(2,3-dimethylphenyl)-2-[(1-hydroxy-2-methylpropan-2-yl)-methylamino]acetamide.

Molecular Properties

Compound NameN-(2,3-dimethylphenyl)-2-[(1-hydroxy-2-methylpropan-2-yl)-methylamino]acetamide
PubChem CID115637950
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC NameN-(2,3-dimethylphenyl)-2-[(1-hydroxy-2-methylpropan-2-yl)-methylamino]acetamide
SMILESCc1cccc(NC(=O)CN(C)C(C)(C)CO)c1C
InChIInChI=1S/C15H24N2O2/c1-11-7-6-8-13(12(11)2)16-14(19)9-17(5)15(3,4)10-18/h6-8,18H,9-10H2,1-5H3,(H,16,19)
InChIKeyIFGCSPKWHOJYEV-UHFFFAOYSA-N
XLogP1.94
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[2-(2,3-dimethylanilino)-2-oxoethyl]-methylamino]-2-methylpropanoic acid
CID 62820404
N-(2,3-dimethylphenyl)-2-hydroxyacetamide
CID 16769655
2-[(3-amino-2,2-dimethylpropyl)-methylamino]-N-(2,3-dimethylphenyl)acetamide
CID 79651972
N,N'-bis(2,3-dimethylphenyl)butanediamide
CID 4250073
N-(2,3-dimethylphenyl)-2-[dimethylsulfamoyl(methyl)amino]acetamide
CID 35329527
2-amino-N-[2-(2,3-dimethylanilino)-2-oxoethyl]-N-methylpropanamide;hydrochloride
CID 119268362
2-[[2-(2,3-dimethylanilino)-2-oxoethyl]-ethylamino]-2-methylpropanoic acid
CID 62821189
N-(2-chloro-4-methylphenyl)-2-[(1-hydroxy-2-methylpropan-2-yl)-methylamino]acetamide
CID 115637893
2-[acetyl(2-methylpropyl)amino]-N-(2,3-dimethylphenyl)acetamide
CID 113158912
N-[2-(2,3-dimethylanilino)-2-oxoethyl]-N-methylbutanamide
CID 27807926
N'-tert-butyl-N-(2,3-dimethylphenyl)propanediamide
CID 108951456
N-(2,3-dimethylphenyl)-2-[methyl-[2-(methylcarbamoylamino)-2-oxoethyl]amino]acetamide
CID 9287446

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylphenyl)-2-[(1-hydroxy-2-methylpropan-2-yl)-methylamino]acetamide?
The IUPAC name of N-(2,3-dimethylphenyl)-2-[(1-hydroxy-2-methylpropan-2-yl)-methylamino]acetamide (CID 115637950) is N-(2,3-dimethylphenyl)-2-[(1-hydroxy-2-methylpropan-2-yl)-methylamino]acetamide.
What is the SMILES notation for N-(2,3-dimethylphenyl)-2-[(1-hydroxy-2-methylpropan-2-yl)-methylamino]acetamide?
The canonical SMILES for N-(2,3-dimethylphenyl)-2-[(1-hydroxy-2-methylpropan-2-yl)-methylamino]acetamide is Cc1cccc(NC(=O)CN(C)C(C)(C)CO)c1C.
What is the InChIKey of N-(2,3-dimethylphenyl)-2-[(1-hydroxy-2-methylpropan-2-yl)-methylamino]acetamide?
The InChIKey is IFGCSPKWHOJYEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-11-7-6-8-13(12(11)2)16-14(19)9-17(5)15(3,4)10-18/h6-8,18H,9-10H2,1-5H3,(H,16,19).
What are the key properties of N-(2,3-dimethylphenyl)-2-[(1-hydroxy-2-methylpropan-2-yl)-methylamino]acetamide?
N-(2,3-dimethylphenyl)-2-[(1-hydroxy-2-methylpropan-2-yl)-methylamino]acetamide has a molecular weight of 264.37 g/mol, XLogP of 1.94, 5 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-[(1-hydroxy-2-methylpropan-2-yl)-methylamino]acetamide is sourced from PubChem (CID 115637950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).