2-[(1R)-2-(ethylcarbamoylamino)-2-oxo-1-phenylethoxy]-N-phenylbenzamide

C24H23N3O4 — CID 7981008

IUPAC2-[(1R)-2-(ethylcarbamoylamino)-2-oxo-1-phenylethoxy]-N-phenylbenzamide
SMILESCCNC(=O)NC(=O)[C@H](Oc1ccccc1C(=O)Nc1ccccc1)c1ccccc1
InChIInChI=1S/C24H23N3O4/c1-2-25-24(30)27-23(29)21(17-11-5-3-6-12-17)31-20-16-10-9-15-19(20)22(28)26-18-13-7-4-8-14-18/h3-16,21H,2H2,1H3,(H,26,28)(H2,25,27,29,30)/t21-/m1/s1
InChIKeyCMTRDBJWGQJVAH-OAQYLSRUSA-N
MW417.47 g/mol
LogP3.90
Rot. Bonds7

About 2-[(1R)-2-(ethylcarbamoylamino)-2-oxo-1-phenylethoxy]-N-phenylbenzamide

2-[(1R)-2-(ethylcarbamoylamino)-2-oxo-1-phenylethoxy]-N-phenylbenzamide (PubChem CID 7981008) has the molecular formula C24H23N3O4 and a molecular weight of 417.47 g/mol. Its IUPAC name is 2-[(1R)-2-(ethylcarbamoylamino)-2-oxo-1-phenylethoxy]-N-phenylbenzamide.

Molecular Properties

Compound Name2-[(1R)-2-(ethylcarbamoylamino)-2-oxo-1-phenylethoxy]-N-phenylbenzamide
PubChem CID7981008
Molecular FormulaC24H23N3O4
Molecular Weight417.47 g/mol
Exact Mass417.17
IUPAC Name2-[(1R)-2-(ethylcarbamoylamino)-2-oxo-1-phenylethoxy]-N-phenylbenzamide
SMILESCCNC(=O)NC(=O)[C@H](Oc1ccccc1C(=O)Nc1ccccc1)c1ccccc1
InChIInChI=1S/C24H23N3O4/c1-2-25-24(30)27-23(29)21(17-11-5-3-6-12-17)31-20-16-10-9-15-19(20)22(28)26-18-13-7-4-8-14-18/h3-16,21H,2H2,1H3,(H,26,28)(H2,25,27,29,30)/t21-/m1/s1
InChIKeyCMTRDBJWGQJVAH-OAQYLSRUSA-N
XLogP3.90
TPSA96.53 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500417.47
LogP ≤ 53.90
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(1R)-2-(cyclopropylamino)-2-oxo-1-phenylethoxy]-N-phenylbenzamide
CID 9416652
(2R)-2-(3-bromophenoxy)-N-(ethylcarbamoyl)-2-phenylacetamide
CID 7818419
(2R)-2-(4-chlorophenoxy)-N-(ethylcarbamoyl)-2-phenylacetamide
CID 7816326
(2R)-N-(ethylcarbamoyl)-2-(3-methylphenoxy)-2-phenylacetamide
CID 7817517
[(1R)-2-(ethylcarbamoylamino)-2-oxo-1-phenylethyl] propanoate
CID 7851438
[(1R)-2-(ethylcarbamoylamino)-2-oxo-1-phenylethyl] naphthalene-1-carboxylate
CID 7785331
[(1R)-2-(ethylcarbamoylamino)-2-oxo-1-phenylethyl] 2-methylsulfanylbenzoate
CID 8526571
[(1S)-2-(ethylcarbamoylamino)-2-oxo-1-phenylethyl] 2,3-dimethylbenzoate
CID 7765259
[(1S)-2-(ethylcarbamoylamino)-2-oxo-1-phenylethyl] 2-[(2-fluorobenzoyl)amino]acetate
CID 9270601
[(1S)-2-(ethylcarbamoylamino)-2-oxo-1-phenylethyl] 2,3,4-trimethoxybenzoate
CID 8611552
(2R)-2-(4-cyano-2-ethoxyphenoxy)-N-(ethylcarbamoyl)-2-phenylacetamide
CID 7993349
[(1S)-2-(ethylcarbamoylamino)-2-oxo-1-phenylethyl] 2-phenylacetate
CID 7875023

Frequently Asked Questions

What is the IUPAC name of 2-[(1R)-2-(ethylcarbamoylamino)-2-oxo-1-phenylethoxy]-N-phenylbenzamide?
The IUPAC name of 2-[(1R)-2-(ethylcarbamoylamino)-2-oxo-1-phenylethoxy]-N-phenylbenzamide (CID 7981008) is 2-[(1R)-2-(ethylcarbamoylamino)-2-oxo-1-phenylethoxy]-N-phenylbenzamide.
What is the SMILES notation for 2-[(1R)-2-(ethylcarbamoylamino)-2-oxo-1-phenylethoxy]-N-phenylbenzamide?
The canonical SMILES for 2-[(1R)-2-(ethylcarbamoylamino)-2-oxo-1-phenylethoxy]-N-phenylbenzamide is CCNC(=O)NC(=O)[C@H](Oc1ccccc1C(=O)Nc1ccccc1)c1ccccc1.
What is the InChIKey of 2-[(1R)-2-(ethylcarbamoylamino)-2-oxo-1-phenylethoxy]-N-phenylbenzamide?
The InChIKey is CMTRDBJWGQJVAH-OAQYLSRUSA-N. The full InChI is InChI=1S/C24H23N3O4/c1-2-25-24(30)27-23(29)21(17-11-5-3-6-12-17)31-20-16-10-9-15-19(20)22(28)26-18-13-7-4-8-14-18/h3-16,21H,2H2,1H3,(H,26,28)(H2,25,27,29,30)/t21-/m1/s1.
What are the key properties of 2-[(1R)-2-(ethylcarbamoylamino)-2-oxo-1-phenylethoxy]-N-phenylbenzamide?
2-[(1R)-2-(ethylcarbamoylamino)-2-oxo-1-phenylethoxy]-N-phenylbenzamide has a molecular weight of 417.47 g/mol, XLogP of 3.90, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1R)-2-(ethylcarbamoylamino)-2-oxo-1-phenylethoxy]-N-phenylbenzamide is sourced from PubChem (CID 7981008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).