2-anilino-N-[3-(2-methylpropoxy)phenyl]acetamide

C18H22N2O2 — CID 54810289

IUPAC2-anilino-N-[3-(2-methylpropoxy)phenyl]acetamide
SMILESCC(C)COc1cccc(NC(=O)CNc2ccccc2)c1
InChIInChI=1S/C18H22N2O2/c1-14(2)13-22-17-10-6-9-16(11-17)20-18(21)12-19-15-7-4-3-5-8-15/h3-11,14,19H,12-13H2,1-2H3,(H,20,21)
InChIKeyGVGLSMLLNPDTRL-UHFFFAOYSA-N
MW298.39 g/mol
LogP3.77
Rot. Bonds7

About 2-anilino-N-[3-(2-methylpropoxy)phenyl]acetamide

2-anilino-N-[3-(2-methylpropoxy)phenyl]acetamide (PubChem CID 54810289) has the molecular formula C18H22N2O2 and a molecular weight of 298.39 g/mol. Its IUPAC name is 2-anilino-N-[3-(2-methylpropoxy)phenyl]acetamide.

Molecular Properties

Compound Name2-anilino-N-[3-(2-methylpropoxy)phenyl]acetamide
PubChem CID54810289
Molecular FormulaC18H22N2O2
Molecular Weight298.39 g/mol
Exact Mass298.17
IUPAC Name2-anilino-N-[3-(2-methylpropoxy)phenyl]acetamide
SMILESCC(C)COc1cccc(NC(=O)CNc2ccccc2)c1
InChIInChI=1S/C18H22N2O2/c1-14(2)13-22-17-10-6-9-16(11-17)20-18(21)12-19-15-7-4-3-5-8-15/h3-11,14,19H,12-13H2,1-2H3,(H,20,21)
InChIKeyGVGLSMLLNPDTRL-UHFFFAOYSA-N
XLogP3.77
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.39
LogP ≤ 53.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-ethoxyanilino)-N-[3-(2-methylpropoxy)phenyl]acetamide
CID 54826384
2-(3-acetamidoanilino)-N-[3-(2-methylpropoxy)phenyl]acetamide
CID 54831499
2-methyl-N-[4-[[2-[3-(2-methylpropoxy)anilino]-2-oxoethyl]amino]phenyl]propanamide
CID 54830634
2-[4-(2-methylpropoxy)anilino]-N-[3-(3-phenylpropoxy)phenyl]acetamide
CID 54820471
3-[[2-[3-(2-methylpropoxy)anilino]acetyl]amino]benzamide
CID 54823168
2-(2-bromoanilino)-N-[3-(2-methylpropoxy)phenyl]acetamide
CID 54816652
2-anilino-N-(3-ethoxyphenyl)acetamide
CID 54810362
3-[3-(2-methylpropoxy)anilino]-3-oxopropanoic acid
CID 62230040
N-(3-butan-2-yloxyphenyl)-2-[4-(2-methylpropoxy)anilino]acetamide
CID 54820106
N-butan-2-yl-4-[[2-[3-(2-methylpropoxy)anilino]-2-oxoethyl]amino]benzamide
CID 54834525
N-(2-methoxyphenyl)-2-[3-(2-methylpropoxy)anilino]acetamide
CID 54823826
2-(3-chloro-4-fluoroanilino)-N-[3-(2-methylpropoxy)phenyl]acetamide
CID 54819041

Frequently Asked Questions

What is the IUPAC name of 2-anilino-N-[3-(2-methylpropoxy)phenyl]acetamide?
The IUPAC name of 2-anilino-N-[3-(2-methylpropoxy)phenyl]acetamide (CID 54810289) is 2-anilino-N-[3-(2-methylpropoxy)phenyl]acetamide.
What is the SMILES notation for 2-anilino-N-[3-(2-methylpropoxy)phenyl]acetamide?
The canonical SMILES for 2-anilino-N-[3-(2-methylpropoxy)phenyl]acetamide is CC(C)COc1cccc(NC(=O)CNc2ccccc2)c1.
What is the InChIKey of 2-anilino-N-[3-(2-methylpropoxy)phenyl]acetamide?
The InChIKey is GVGLSMLLNPDTRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O2/c1-14(2)13-22-17-10-6-9-16(11-17)20-18(21)12-19-15-7-4-3-5-8-15/h3-11,14,19H,12-13H2,1-2H3,(H,20,21).
What are the key properties of 2-anilino-N-[3-(2-methylpropoxy)phenyl]acetamide?
2-anilino-N-[3-(2-methylpropoxy)phenyl]acetamide has a molecular weight of 298.39 g/mol, XLogP of 3.77, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-anilino-N-[3-(2-methylpropoxy)phenyl]acetamide is sourced from PubChem (CID 54810289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).