5-chloro-2-[2-(cyclohexylamino)-2-oxoethoxy]-N-phenylbenzamide

C21H23ClN2O3 — CID 7893364

IUPAC5-chloro-2-[2-(cyclohexylamino)-2-oxoethoxy]-N-phenylbenzamide
SMILESO=C(COc1ccc(Cl)cc1C(=O)Nc1ccccc1)NC1CCCCC1
InChIInChI=1S/C21H23ClN2O3/c22-15-11-12-19(27-14-20(25)23-16-7-3-1-4-8-16)18(13-15)21(26)24-17-9-5-2-6-10-17/h2,5-6,9-13,16H,1,3-4,7-8,14H2,(H,23,25)(H,24,26)
InChIKeyOHEVPVNPLZEXFJ-UHFFFAOYSA-N
MW386.88 g/mol
LogP4.42
Rot. Bonds6

About 5-chloro-2-[2-(cyclohexylamino)-2-oxoethoxy]-N-phenylbenzamide

5-chloro-2-[2-(cyclohexylamino)-2-oxoethoxy]-N-phenylbenzamide (PubChem CID 7893364) has the molecular formula C21H23ClN2O3 and a molecular weight of 386.88 g/mol. Its IUPAC name is 5-chloro-2-[2-(cyclohexylamino)-2-oxoethoxy]-N-phenylbenzamide.

Molecular Properties

Compound Name5-chloro-2-[2-(cyclohexylamino)-2-oxoethoxy]-N-phenylbenzamide
PubChem CID7893364
Molecular FormulaC21H23ClN2O3
Molecular Weight386.88 g/mol
Exact Mass386.14
IUPAC Name5-chloro-2-[2-(cyclohexylamino)-2-oxoethoxy]-N-phenylbenzamide
SMILESO=C(COc1ccc(Cl)cc1C(=O)Nc1ccccc1)NC1CCCCC1
InChIInChI=1S/C21H23ClN2O3/c22-15-11-12-19(27-14-20(25)23-16-7-3-1-4-8-16)18(13-15)21(26)24-17-9-5-2-6-10-17/h2,5-6,9-13,16H,1,3-4,7-8,14H2,(H,23,25)(H,24,26)
InChIKeyOHEVPVNPLZEXFJ-UHFFFAOYSA-N
XLogP4.42
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.88
LogP ≤ 54.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(cyclohexylcarbamoylamino)-2-oxoethoxy]-N-phenylbenzamide
CID 7980853
5-chloro-2-[2-[(1-cyanocyclopentyl)amino]-2-oxoethoxy]-N-phenylbenzamide
CID 24578741
N-cyclopentyl-2-(2,5-dichlorophenoxy)acetamide
CID 841562
5-chloro-2-[2-(diethylamino)-2-oxoethoxy]-N-phenylbenzamide
CID 7893374
[4-chloro-2-[[4-(trifluoromethyl)phenyl]carbamoyl]phenyl] N-cyclohexylcarbamate
CID 155556041
5-chloro-2-[2-(N-(1,1-dioxothiolan-3-yl)anilino)-2-oxoethoxy]-N-phenylbenzamide
CID 24578752
[2-(cycloheptylamino)-2-oxoethyl] 2,5-dichlorobenzoate
CID 4803859
N-cyclopropyl-2-[[2-(2,4-dichlorophenoxy)acetyl]amino]benzamide
CID 7729391
2-[2-(4-chloro-2-fluoroanilino)-2-oxoethoxy]-N-phenylbenzamide
CID 8852932
[2-(cyclopentylamino)-2-oxoethyl] 2-(2,4-dichlorophenoxy)acetate
CID 3987255
N-cyclopentyl-2-[[2-(2,4-dichlorophenoxy)acetyl]amino]acetamide
CID 112990888
2-[2-[1-(1,3-benzodioxol-5-yl)ethylamino]-2-oxoethoxy]-5-chloro-N-phenylbenzamide
CID 24578747

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-[2-(cyclohexylamino)-2-oxoethoxy]-N-phenylbenzamide?
The IUPAC name of 5-chloro-2-[2-(cyclohexylamino)-2-oxoethoxy]-N-phenylbenzamide (CID 7893364) is 5-chloro-2-[2-(cyclohexylamino)-2-oxoethoxy]-N-phenylbenzamide.
What is the SMILES notation for 5-chloro-2-[2-(cyclohexylamino)-2-oxoethoxy]-N-phenylbenzamide?
The canonical SMILES for 5-chloro-2-[2-(cyclohexylamino)-2-oxoethoxy]-N-phenylbenzamide is O=C(COc1ccc(Cl)cc1C(=O)Nc1ccccc1)NC1CCCCC1.
What is the InChIKey of 5-chloro-2-[2-(cyclohexylamino)-2-oxoethoxy]-N-phenylbenzamide?
The InChIKey is OHEVPVNPLZEXFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23ClN2O3/c22-15-11-12-19(27-14-20(25)23-16-7-3-1-4-8-16)18(13-15)21(26)24-17-9-5-2-6-10-17/h2,5-6,9-13,16H,1,3-4,7-8,14H2,(H,23,25)(H,24,26).
What are the key properties of 5-chloro-2-[2-(cyclohexylamino)-2-oxoethoxy]-N-phenylbenzamide?
5-chloro-2-[2-(cyclohexylamino)-2-oxoethoxy]-N-phenylbenzamide has a molecular weight of 386.88 g/mol, XLogP of 4.42, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-[2-(cyclohexylamino)-2-oxoethoxy]-N-phenylbenzamide is sourced from PubChem (CID 7893364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).