N-[2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]-2-oxoethyl]-2-methoxybenzamide

C18H19ClN2O3 — CID 41176984

IUPACN-[2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]-2-oxoethyl]-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)NCC(=O)N[C@H](C)c1ccccc1Cl
InChIInChI=1S/C18H19ClN2O3/c1-12(13-7-3-5-9-15(13)19)21-17(22)11-20-18(23)14-8-4-6-10-16(14)24-2/h3-10,12H,11H2,1-2H3,(H,20,23)(H,21,22)/t12-/m1/s1
InChIKeyFFHJXQNGYNKPMS-GFCCVEGCSA-N
MW346.81 g/mol
LogP2.96
Rot. Bonds6

About N-[2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]-2-oxoethyl]-2-methoxybenzamide

N-[2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]-2-oxoethyl]-2-methoxybenzamide (PubChem CID 41176984) has the molecular formula C18H19ClN2O3 and a molecular weight of 346.81 g/mol. Its IUPAC name is N-[2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]-2-oxoethyl]-2-methoxybenzamide.

Molecular Properties

Compound NameN-[2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]-2-oxoethyl]-2-methoxybenzamide
PubChem CID41176984
Molecular FormulaC18H19ClN2O3
Molecular Weight346.81 g/mol
Exact Mass346.11
IUPAC NameN-[2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]-2-oxoethyl]-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)NCC(=O)N[C@H](C)c1ccccc1Cl
InChIInChI=1S/C18H19ClN2O3/c1-12(13-7-3-5-9-15(13)19)21-17(22)11-20-18(23)14-8-4-6-10-16(14)24-2/h3-10,12H,11H2,1-2H3,(H,20,23)(H,21,22)/t12-/m1/s1
InChIKeyFFHJXQNGYNKPMS-GFCCVEGCSA-N
XLogP2.96
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.81
LogP ≤ 52.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[2-[1-(2-methoxyphenyl)ethylamino]-2-oxoethyl] 2-[(2-methoxybenzoyl)amino]acetate
CID 55365939
N-benzyl-2-[2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]-2-oxoethoxy]benzamide
CID 7981698
N-[2-[[(4-chlorophenyl)-phenylmethyl]amino]-2-oxoethyl]-2-methoxybenzamide
CID 112772541
N-[2-[2-[2-(2-chlorophenoxy)acetyl]hydrazinyl]-2-oxoethyl]-2-methoxybenzamide
CID 7601129
N-[2-[(2-chlorobenzoyl)amino]ethyl]-2-methoxybenzamide
CID 40718510
N-[2-[1-(2-chlorophenyl)ethylamino]-2-oxoethyl]-3,4-dimethylbenzamide
CID 24543962
N-[2-(ethylamino)-2-oxoethyl]-2-methoxybenzamide
CID 2687892
N-[(1R)-1-(2-chlorophenyl)ethyl]-2,4,5-trimethoxybenzamide
CID 26907645
2-chloro-N-[2-[1-[3-methoxy-4-(2-methoxyethoxy)phenyl]ethylamino]-2-oxoethyl]benzamide
CID 55869434
N-[1-(2-chlorophenyl)ethyl]-2-(methylamino)acetamide
CID 60641198
N-[(1S)-1-(2-chlorophenyl)ethyl]-2,4-dimethoxybenzamide
CID 26907594
2-amino-N-[2-[[(1R)-1-(2-methoxyphenyl)ethyl]amino]-2-oxoethyl]acetamide
CID 81387632

Frequently Asked Questions

What is the IUPAC name of N-[2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]-2-oxoethyl]-2-methoxybenzamide?
The IUPAC name of N-[2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]-2-oxoethyl]-2-methoxybenzamide (CID 41176984) is N-[2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]-2-oxoethyl]-2-methoxybenzamide.
What is the SMILES notation for N-[2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]-2-oxoethyl]-2-methoxybenzamide?
The canonical SMILES for N-[2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]-2-oxoethyl]-2-methoxybenzamide is COc1ccccc1C(=O)NCC(=O)N[C@H](C)c1ccccc1Cl.
What is the InChIKey of N-[2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]-2-oxoethyl]-2-methoxybenzamide?
The InChIKey is FFHJXQNGYNKPMS-GFCCVEGCSA-N. The full InChI is InChI=1S/C18H19ClN2O3/c1-12(13-7-3-5-9-15(13)19)21-17(22)11-20-18(23)14-8-4-6-10-16(14)24-2/h3-10,12H,11H2,1-2H3,(H,20,23)(H,21,22)/t12-/m1/s1.
What are the key properties of N-[2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]-2-oxoethyl]-2-methoxybenzamide?
N-[2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]-2-oxoethyl]-2-methoxybenzamide has a molecular weight of 346.81 g/mol, XLogP of 2.96, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]-2-oxoethyl]-2-methoxybenzamide is sourced from PubChem (CID 41176984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).