2-[2-(2-amino-2-oxoethoxy)-5-methylphenyl]benzamide

C16H16N2O3 — CID 72860190

IUPAC2-[2-(2-amino-2-oxoethoxy)-5-methylphenyl]benzamide
SMILESCc1ccc(OCC(N)=O)c(-c2ccccc2C(N)=O)c1
InChIInChI=1S/C16H16N2O3/c1-10-6-7-14(21-9-15(17)19)13(8-10)11-4-2-3-5-12(11)16(18)20/h2-8H,9H2,1H3,(H2,17,19)(H2,18,20)
InChIKeyLBROSKHORZWJKS-UHFFFAOYSA-N
MW284.32 g/mol
LogP1.63
Rot. Bonds5

About 2-[2-(2-amino-2-oxoethoxy)-5-methylphenyl]benzamide

2-[2-(2-amino-2-oxoethoxy)-5-methylphenyl]benzamide (PubChem CID 72860190) has the molecular formula C16H16N2O3 and a molecular weight of 284.32 g/mol. Its IUPAC name is 2-[2-(2-amino-2-oxoethoxy)-5-methylphenyl]benzamide.

Molecular Properties

Compound Name2-[2-(2-amino-2-oxoethoxy)-5-methylphenyl]benzamide
PubChem CID72860190
Molecular FormulaC16H16N2O3
Molecular Weight284.32 g/mol
Exact Mass284.12
IUPAC Name2-[2-(2-amino-2-oxoethoxy)-5-methylphenyl]benzamide
SMILESCc1ccc(OCC(N)=O)c(-c2ccccc2C(N)=O)c1
InChIInChI=1S/C16H16N2O3/c1-10-6-7-14(21-9-15(17)19)13(8-10)11-4-2-3-5-12(11)16(18)20/h2-8H,9H2,1H3,(H2,17,19)(H2,18,20)
InChIKeyLBROSKHORZWJKS-UHFFFAOYSA-N
XLogP1.63
TPSA95.41 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.32
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-methoxy-5-methylphenyl)benzamide
CID 66715055
[2-(2,5-dimethylphenyl)-2-oxoethyl] 2-(2-amino-2-oxoethoxy)benzoate
CID 46641142
2-[2-(2-fluoro-6-methoxyphenyl)-4-methylphenoxy]acetamide
CID 56717628
2-[4-methyl-2-(methylaminomethyl)phenoxy]acetamide
CID 63322657
methyl 2-(2-amino-2-oxoethoxy)-4-methylbenzoate
CID 145310758
2-(2-amino-2-oxoethoxy)-N-(2-methoxy-5-methylphenyl)benzamide
CID 9453585
2-(2-amino-2-oxoethoxy)-N-(2,5-dimethylphenyl)benzamide
CID 34795428
2-(2-butoxyphenyl)benzamide
CID 174985404
2-(2-amino-2-oxoethoxy)benzamide;ethanesulfonic acid
CID 172768099
2-(4-methyl-2-nitrophenoxy)acetamide
CID 8538614
2-(5-methyl-2-propan-2-ylphenoxy)acetamide
CID 681895
2-[2-[(1S)-1-aminoethyl]-5-methylphenoxy]acetamide
CID 78946963

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-amino-2-oxoethoxy)-5-methylphenyl]benzamide?
The IUPAC name of 2-[2-(2-amino-2-oxoethoxy)-5-methylphenyl]benzamide (CID 72860190) is 2-[2-(2-amino-2-oxoethoxy)-5-methylphenyl]benzamide.
What is the SMILES notation for 2-[2-(2-amino-2-oxoethoxy)-5-methylphenyl]benzamide?
The canonical SMILES for 2-[2-(2-amino-2-oxoethoxy)-5-methylphenyl]benzamide is Cc1ccc(OCC(N)=O)c(-c2ccccc2C(N)=O)c1.
What is the InChIKey of 2-[2-(2-amino-2-oxoethoxy)-5-methylphenyl]benzamide?
The InChIKey is LBROSKHORZWJKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O3/c1-10-6-7-14(21-9-15(17)19)13(8-10)11-4-2-3-5-12(11)16(18)20/h2-8H,9H2,1H3,(H2,17,19)(H2,18,20).
What are the key properties of 2-[2-(2-amino-2-oxoethoxy)-5-methylphenyl]benzamide?
2-[2-(2-amino-2-oxoethoxy)-5-methylphenyl]benzamide has a molecular weight of 284.32 g/mol, XLogP of 1.63, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-amino-2-oxoethoxy)-5-methylphenyl]benzamide is sourced from PubChem (CID 72860190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).