N-benzyl-N-methyl-2-[2-(2-methylpropoxy)anilino]acetamide

C20H26N2O2 — CID 54824074

IUPACN-benzyl-N-methyl-2-[2-(2-methylpropoxy)anilino]acetamide
SMILESCC(C)COc1ccccc1NCC(=O)N(C)Cc1ccccc1
InChIInChI=1S/C20H26N2O2/c1-16(2)15-24-19-12-8-7-11-18(19)21-13-20(23)22(3)14-17-9-5-4-6-10-17/h4-12,16,21H,13-15H2,1-3H3
InChIKeyWQARHBOYKQYQTN-UHFFFAOYSA-N
MW326.44 g/mol
LogP3.79
Rot. Bonds8

About N-benzyl-N-methyl-2-[2-(2-methylpropoxy)anilino]acetamide

N-benzyl-N-methyl-2-[2-(2-methylpropoxy)anilino]acetamide (PubChem CID 54824074) has the molecular formula C20H26N2O2 and a molecular weight of 326.44 g/mol. Its IUPAC name is N-benzyl-N-methyl-2-[2-(2-methylpropoxy)anilino]acetamide.

Molecular Properties

Compound NameN-benzyl-N-methyl-2-[2-(2-methylpropoxy)anilino]acetamide
PubChem CID54824074
Molecular FormulaC20H26N2O2
Molecular Weight326.44 g/mol
Exact Mass326.20
IUPAC NameN-benzyl-N-methyl-2-[2-(2-methylpropoxy)anilino]acetamide
SMILESCC(C)COc1ccccc1NCC(=O)N(C)Cc1ccccc1
InChIInChI=1S/C20H26N2O2/c1-16(2)15-24-19-12-8-7-11-18(19)21-13-20(23)22(3)14-17-9-5-4-6-10-17/h4-12,16,21H,13-15H2,1-3H3
InChIKeyWQARHBOYKQYQTN-UHFFFAOYSA-N
XLogP3.79
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.44
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-benzyl-N-methyl-2-(2-methylanilino)acetamide
CID 39367191
2-[2-(2-methylpropoxy)anilino]-N-(4-phenylmethoxyphenyl)acetamide
CID 54824046
2-(2-methoxyanilino)-N-[2-(2-methylpropoxy)phenyl]acetamide
CID 54817214
N-benzyl-2-(3-ethoxyanilino)-N-methylacetamide
CID 54824566
N,N'-dibenzyl-N,N'-dimethylpropanediamide
CID 2392235
N-benzyl-2-formamido-N-methylacetamide
CID 18618309
N-benzyl-N-methyl-2-[4-(2-phenoxyethoxy)anilino]acetamide
CID 54821466
N-[4-[[2-[2-(2-methylpropoxy)anilino]acetyl]amino]phenyl]propanamide
CID 54823688
N-benzyl-2-(2,6-diethylanilino)-N-methylacetamide
CID 108997433
2-(2-methylpropoxy)-N-(pyridin-3-ylmethyl)aniline
CID 54864920
2-(2,3-dimethylanilino)-N-[2-(2-methylpropoxy)phenyl]acetamide
CID 54815991
2-(2-phenylmethoxyanilino)-N-propan-2-ylacetamide
CID 54828083

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-methyl-2-[2-(2-methylpropoxy)anilino]acetamide?
The IUPAC name of N-benzyl-N-methyl-2-[2-(2-methylpropoxy)anilino]acetamide (CID 54824074) is N-benzyl-N-methyl-2-[2-(2-methylpropoxy)anilino]acetamide.
What is the SMILES notation for N-benzyl-N-methyl-2-[2-(2-methylpropoxy)anilino]acetamide?
The canonical SMILES for N-benzyl-N-methyl-2-[2-(2-methylpropoxy)anilino]acetamide is CC(C)COc1ccccc1NCC(=O)N(C)Cc1ccccc1.
What is the InChIKey of N-benzyl-N-methyl-2-[2-(2-methylpropoxy)anilino]acetamide?
The InChIKey is WQARHBOYKQYQTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O2/c1-16(2)15-24-19-12-8-7-11-18(19)21-13-20(23)22(3)14-17-9-5-4-6-10-17/h4-12,16,21H,13-15H2,1-3H3.
What are the key properties of N-benzyl-N-methyl-2-[2-(2-methylpropoxy)anilino]acetamide?
N-benzyl-N-methyl-2-[2-(2-methylpropoxy)anilino]acetamide has a molecular weight of 326.44 g/mol, XLogP of 3.79, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-methyl-2-[2-(2-methylpropoxy)anilino]acetamide is sourced from PubChem (CID 54824074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).