N-(2-amino-2-oxoethyl)-4-chloro-2-methoxybenzamide

C10H11ClN2O3 — CID 63362049

IUPACN-(2-amino-2-oxoethyl)-4-chloro-2-methoxybenzamide
SMILESCOc1cc(Cl)ccc1C(=O)NCC(N)=O
InChIInChI=1S/C10H11ClN2O3/c1-16-8-4-6(11)2-3-7(8)10(15)13-5-9(12)14/h2-4H,5H2,1H3,(H2,12,14)(H,13,15)
InChIKeyJGZHHKMRCFGOJZ-UHFFFAOYSA-N
MW242.66 g/mol
LogP0.56
Rot. Bonds4

About N-(2-amino-2-oxoethyl)-4-chloro-2-methoxybenzamide

N-(2-amino-2-oxoethyl)-4-chloro-2-methoxybenzamide (PubChem CID 63362049) has the molecular formula C10H11ClN2O3 and a molecular weight of 242.66 g/mol. Its IUPAC name is N-(2-amino-2-oxoethyl)-4-chloro-2-methoxybenzamide.

Molecular Properties

Compound NameN-(2-amino-2-oxoethyl)-4-chloro-2-methoxybenzamide
PubChem CID63362049
Molecular FormulaC10H11ClN2O3
Molecular Weight242.66 g/mol
Exact Mass242.05
IUPAC NameN-(2-amino-2-oxoethyl)-4-chloro-2-methoxybenzamide
SMILESCOc1cc(Cl)ccc1C(=O)NCC(N)=O
InChIInChI=1S/C10H11ClN2O3/c1-16-8-4-6(11)2-3-7(8)10(15)13-5-9(12)14/h2-4H,5H2,1H3,(H2,12,14)(H,13,15)
InChIKeyJGZHHKMRCFGOJZ-UHFFFAOYSA-N
XLogP0.56
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.66
LogP ≤ 50.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-amino-2-ethylbutyl)-4-chloro-2-methoxybenzamide
CID 81484738
4-chloro-2-methoxybenzamide
CID 19741766
(2R)-4-amino-2-[(4-chloro-2-methoxybenzoyl)amino]-4-oxobutanoic acid
CID 107821307
4-chloro-N-[(3-chlorophenyl)methyl]-2-methoxybenzamide
CID 47449773
4-chloro-2-methoxy-N-[(4-methylphenyl)methyl]benzamide
CID 47449992
4-chloro-N-(2-chloro-3-methylbutyl)-2-methoxybenzamide
CID 113492957
2-amino-N-(2-amino-2-oxoethyl)-5-chlorobenzamide
CID 16778185
4-chloro-N-[2-(2-hydroxyethoxy)ethyl]-2-methoxybenzamide
CID 62498440
4-chloro-2-methoxy-N-[(E)-pent-3-enyl]benzamide
CID 113236443
N-[(3-aminophenyl)methyl]-4-chloro-2-methoxybenzamide
CID 62500246
4-chloro-2-methoxy-N-[(4-propan-2-ylphenyl)methyl]benzamide
CID 71822149
1-[[(4-chloro-2-methoxybenzoyl)amino]methyl]cyclopropane-1-carboxylic acid
CID 115449594

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-oxoethyl)-4-chloro-2-methoxybenzamide?
The IUPAC name of N-(2-amino-2-oxoethyl)-4-chloro-2-methoxybenzamide (CID 63362049) is N-(2-amino-2-oxoethyl)-4-chloro-2-methoxybenzamide.
What is the SMILES notation for N-(2-amino-2-oxoethyl)-4-chloro-2-methoxybenzamide?
The canonical SMILES for N-(2-amino-2-oxoethyl)-4-chloro-2-methoxybenzamide is COc1cc(Cl)ccc1C(=O)NCC(N)=O.
What is the InChIKey of N-(2-amino-2-oxoethyl)-4-chloro-2-methoxybenzamide?
The InChIKey is JGZHHKMRCFGOJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11ClN2O3/c1-16-8-4-6(11)2-3-7(8)10(15)13-5-9(12)14/h2-4H,5H2,1H3,(H2,12,14)(H,13,15).
What are the key properties of N-(2-amino-2-oxoethyl)-4-chloro-2-methoxybenzamide?
N-(2-amino-2-oxoethyl)-4-chloro-2-methoxybenzamide has a molecular weight of 242.66 g/mol, XLogP of 0.56, 4 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)-4-chloro-2-methoxybenzamide is sourced from PubChem (CID 63362049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).