3-(2-amino-2-oxoethoxy)-N-[(2-chlorophenyl)methyl]benzamide

C16H15ClN2O3 — CID 35558245

IUPAC3-(2-amino-2-oxoethoxy)-N-[(2-chlorophenyl)methyl]benzamide
SMILESNC(=O)COc1cccc(C(=O)NCc2ccccc2Cl)c1
InChIInChI=1S/C16H15ClN2O3/c17-14-7-2-1-4-12(14)9-19-16(21)11-5-3-6-13(8-11)22-10-15(18)20/h1-8H,9-10H2,(H2,18,20)(H,19,21)
InChIKeyLPRNYPHOSHIGFQ-UHFFFAOYSA-N
MW318.76 g/mol
LogP2.13
Rot. Bonds6

About 3-(2-amino-2-oxoethoxy)-N-[(2-chlorophenyl)methyl]benzamide

3-(2-amino-2-oxoethoxy)-N-[(2-chlorophenyl)methyl]benzamide (PubChem CID 35558245) has the molecular formula C16H15ClN2O3 and a molecular weight of 318.76 g/mol. Its IUPAC name is 3-(2-amino-2-oxoethoxy)-N-[(2-chlorophenyl)methyl]benzamide.

Molecular Properties

Compound Name3-(2-amino-2-oxoethoxy)-N-[(2-chlorophenyl)methyl]benzamide
PubChem CID35558245
Molecular FormulaC16H15ClN2O3
Molecular Weight318.76 g/mol
Exact Mass318.08
IUPAC Name3-(2-amino-2-oxoethoxy)-N-[(2-chlorophenyl)methyl]benzamide
SMILESNC(=O)COc1cccc(C(=O)NCc2ccccc2Cl)c1
InChIInChI=1S/C16H15ClN2O3/c17-14-7-2-1-4-12(14)9-19-16(21)11-5-3-6-13(8-11)22-10-15(18)20/h1-8H,9-10H2,(H2,18,20)(H,19,21)
InChIKeyLPRNYPHOSHIGFQ-UHFFFAOYSA-N
XLogP2.13
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.76
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2-chlorophenyl)methyl]-3-(2-methylprop-2-enoxy)benzamide
CID 17194215
N-[(2-chlorophenyl)methyl]-3-ethoxybenzamide
CID 2971835
N-[(2-chlorophenyl)methyl]-3-methoxybenzamide
CID 790117
N-[(2-chlorophenyl)methyl]-3-(pyridin-3-ylmethoxy)benzamide
CID 55772208
N-[(2-chlorophenyl)methyl]-3-(6-methylpyridazin-3-yl)oxybenzamide
CID 70703420
3-[(2-chlorophenyl)methoxy]-N-(pyridin-4-ylmethyl)benzamide
CID 30155863
N-[(2-chlorophenyl)methylcarbamothioyl]-3-ethoxybenzamide
CID 17194426
N-[(2-chlorophenyl)methyl]-3,5-dimethoxybenzamide
CID 881091
3-(2-amino-2-oxoethoxy)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]benzamide
CID 134048512
N-[(2-chlorophenyl)methyl]-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide
CID 24542001
3-[(2-chlorophenyl)methoxy]-N-prop-2-enylbenzamide
CID 30155712
[(2S)-1-[(2-chlorophenyl)methylamino]-1-oxopropan-2-yl] 2-(3-acetylphenoxy)acetate
CID 8735586

Frequently Asked Questions

What is the IUPAC name of 3-(2-amino-2-oxoethoxy)-N-[(2-chlorophenyl)methyl]benzamide?
The IUPAC name of 3-(2-amino-2-oxoethoxy)-N-[(2-chlorophenyl)methyl]benzamide (CID 35558245) is 3-(2-amino-2-oxoethoxy)-N-[(2-chlorophenyl)methyl]benzamide.
What is the SMILES notation for 3-(2-amino-2-oxoethoxy)-N-[(2-chlorophenyl)methyl]benzamide?
The canonical SMILES for 3-(2-amino-2-oxoethoxy)-N-[(2-chlorophenyl)methyl]benzamide is NC(=O)COc1cccc(C(=O)NCc2ccccc2Cl)c1.
What is the InChIKey of 3-(2-amino-2-oxoethoxy)-N-[(2-chlorophenyl)methyl]benzamide?
The InChIKey is LPRNYPHOSHIGFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15ClN2O3/c17-14-7-2-1-4-12(14)9-19-16(21)11-5-3-6-13(8-11)22-10-15(18)20/h1-8H,9-10H2,(H2,18,20)(H,19,21).
What are the key properties of 3-(2-amino-2-oxoethoxy)-N-[(2-chlorophenyl)methyl]benzamide?
3-(2-amino-2-oxoethoxy)-N-[(2-chlorophenyl)methyl]benzamide has a molecular weight of 318.76 g/mol, XLogP of 2.13, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-amino-2-oxoethoxy)-N-[(2-chlorophenyl)methyl]benzamide is sourced from PubChem (CID 35558245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).