N-(2-amino-2-oxoethyl)-3-hydroxy-N,2-dimethylbenzamide

C11H14N2O3 — CID 82829163

IUPACN-(2-amino-2-oxoethyl)-3-hydroxy-N,2-dimethylbenzamide
SMILESCc1c(O)cccc1C(=O)N(C)CC(N)=O
InChIInChI=1S/C11H14N2O3/c1-7-8(4-3-5-9(7)14)11(16)13(2)6-10(12)15/h3-5,14H,6H2,1-2H3,(H2,12,15)
InChIKeyGLQUIOHNZKOJAT-UHFFFAOYSA-N
MW222.24 g/mol
LogP0.26
Rot. Bonds3

About N-(2-amino-2-oxoethyl)-3-hydroxy-N,2-dimethylbenzamide

N-(2-amino-2-oxoethyl)-3-hydroxy-N,2-dimethylbenzamide (PubChem CID 82829163) has the molecular formula C11H14N2O3 and a molecular weight of 222.24 g/mol. Its IUPAC name is N-(2-amino-2-oxoethyl)-3-hydroxy-N,2-dimethylbenzamide.

Molecular Properties

Compound NameN-(2-amino-2-oxoethyl)-3-hydroxy-N,2-dimethylbenzamide
PubChem CID82829163
Molecular FormulaC11H14N2O3
Molecular Weight222.24 g/mol
Exact Mass222.10
IUPAC NameN-(2-amino-2-oxoethyl)-3-hydroxy-N,2-dimethylbenzamide
SMILESCc1c(O)cccc1C(=O)N(C)CC(N)=O
InChIInChI=1S/C11H14N2O3/c1-7-8(4-3-5-9(7)14)11(16)13(2)6-10(12)15/h3-5,14H,6H2,1-2H3,(H2,12,15)
InChIKeyGLQUIOHNZKOJAT-UHFFFAOYSA-N
XLogP0.26
TPSA83.63 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.24
LogP ≤ 50.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-amino-2-oxoethyl)-2-fluoro-N,3-dimethylbenzamide
CID 80718993
3-hydroxy-N,2-dimethyl-N-(2-methylpropyl)benzamide
CID 82829951
N-[(4-aminophenyl)methyl]-3-hydroxy-N,2-dimethylbenzamide
CID 82827016
N-(2-amino-2-oxoethyl)-N-methyl-2-sulfanylbenzamide
CID 107022665
3-amino-N-(2-amino-2-oxoethyl)-2-chloro-N-methylbenzamide
CID 112574760
3-hydroxy-N-[2-(2-methoxyethylamino)-2-oxoethyl]-N,2-dimethylbenzamide
CID 82829175
N-(2-amino-2-oxoethyl)-2-chloro-N-methylpyridine-3-carboxamide
CID 43374214
N-[(3-aminophenyl)methyl]-3-hydroxy-N,2-dimethylbenzamide
CID 82826934
N-(cyclopentylmethyl)-3-hydroxy-N,2-dimethylbenzamide
CID 82828965
N-(cyclobutylmethyl)-3-hydroxy-N,2-dimethylbenzamide
CID 82829035
3-hydroxy-N,2-dimethyl-N-[(5-methylfuran-2-yl)methyl]benzamide
CID 82786543
N-(2-cyanopropyl)-3-hydroxy-N,2-dimethylbenzamide
CID 82829304

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-oxoethyl)-3-hydroxy-N,2-dimethylbenzamide?
The IUPAC name of N-(2-amino-2-oxoethyl)-3-hydroxy-N,2-dimethylbenzamide (CID 82829163) is N-(2-amino-2-oxoethyl)-3-hydroxy-N,2-dimethylbenzamide.
What is the SMILES notation for N-(2-amino-2-oxoethyl)-3-hydroxy-N,2-dimethylbenzamide?
The canonical SMILES for N-(2-amino-2-oxoethyl)-3-hydroxy-N,2-dimethylbenzamide is Cc1c(O)cccc1C(=O)N(C)CC(N)=O.
What is the InChIKey of N-(2-amino-2-oxoethyl)-3-hydroxy-N,2-dimethylbenzamide?
The InChIKey is GLQUIOHNZKOJAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O3/c1-7-8(4-3-5-9(7)14)11(16)13(2)6-10(12)15/h3-5,14H,6H2,1-2H3,(H2,12,15).
What are the key properties of N-(2-amino-2-oxoethyl)-3-hydroxy-N,2-dimethylbenzamide?
N-(2-amino-2-oxoethyl)-3-hydroxy-N,2-dimethylbenzamide has a molecular weight of 222.24 g/mol, XLogP of 0.26, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-oxoethyl)-3-hydroxy-N,2-dimethylbenzamide is sourced from PubChem (CID 82829163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).