2-chloro-5-morpholin-4-ylsulfonyl-N-(2-phenylethyl)benzamide

C19H21ClN2O4S — CID 27670888

IUPAC2-chloro-5-morpholin-4-ylsulfonyl-N-(2-phenylethyl)benzamide
SMILESO=C(NCCc1ccccc1)c1cc(S(=O)(=O)N2CCOCC2)ccc1Cl
InChIInChI=1S/C19H21ClN2O4S/c20-18-7-6-16(27(24,25)22-10-12-26-13-11-22)14-17(18)19(23)21-9-8-15-4-2-1-3-5-15/h1-7,14H,8-13H2,(H,21,23)
InChIKeyWHFZEAIWNLTHFY-UHFFFAOYSA-N
MW408.91 g/mol
LogP2.33
Rot. Bonds6

About 2-chloro-5-morpholin-4-ylsulfonyl-N-(2-phenylethyl)benzamide

2-chloro-5-morpholin-4-ylsulfonyl-N-(2-phenylethyl)benzamide (PubChem CID 27670888) has the molecular formula C19H21ClN2O4S and a molecular weight of 408.91 g/mol. Its IUPAC name is 2-chloro-5-morpholin-4-ylsulfonyl-N-(2-phenylethyl)benzamide.

Molecular Properties

Compound Name2-chloro-5-morpholin-4-ylsulfonyl-N-(2-phenylethyl)benzamide
PubChem CID27670888
Molecular FormulaC19H21ClN2O4S
Molecular Weight408.91 g/mol
Exact Mass408.09
IUPAC Name2-chloro-5-morpholin-4-ylsulfonyl-N-(2-phenylethyl)benzamide
SMILESO=C(NCCc1ccccc1)c1cc(S(=O)(=O)N2CCOCC2)ccc1Cl
InChIInChI=1S/C19H21ClN2O4S/c20-18-7-6-16(27(24,25)22-10-12-26-13-11-22)14-17(18)19(23)21-9-8-15-4-2-1-3-5-15/h1-7,14H,8-13H2,(H,21,23)
InChIKeyWHFZEAIWNLTHFY-UHFFFAOYSA-N
XLogP2.33
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.91
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-chloro-5-morpholin-4-ylsulfonyl-N-(4-phenylbutyl)benzamide
CID 17484284
2-chloro-N-(2-phenylethyl)-5-piperidin-1-ylsulfonylbenzamide
CID 26534993
2-chloro-5-morpholin-4-ylsulfonyl-N-(2-phenoxyethyl)benzamide
CID 26903364
1-(2-chloro-5-morpholin-4-ylsulfonylphenyl)-3-(2-phenylethyl)urea
CID 108888055
2-chloro-5-morpholin-4-ylsulfonyl-N-[(2S)-4-phenylbutan-2-yl]benzamide
CID 35728362
2-chloro-N-(2-methyl-1-phenylpropan-2-yl)-5-morpholin-4-ylsulfonylbenzamide
CID 100507560
N-[2-(1H-benzimidazol-2-yl)ethyl]-2-chloro-5-morpholin-4-ylsulfonylbenzamide
CID 21008889
2-phenylethyl 2-chloro-5-morpholin-4-ylsulfonylbenzoate
CID 1081914
2-methyl-5-morpholin-4-ylsulfonyl-N-(2-pyridin-3-ylethyl)benzamide
CID 55555141
1-methyl-4-morpholin-4-ylsulfonyl-N-(2-phenylethyl)pyrrole-2-carboxamide
CID 22519089
2-chloro-N-[2-(4-fluorophenyl)ethyl]-5-piperidin-1-ylsulfonylbenzamide
CID 4002004
N-[2-(butylcarbamoyl)phenyl]-2-chloro-5-morpholin-4-ylsulfonylbenzamide
CID 28590712

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-morpholin-4-ylsulfonyl-N-(2-phenylethyl)benzamide?
The IUPAC name of 2-chloro-5-morpholin-4-ylsulfonyl-N-(2-phenylethyl)benzamide (CID 27670888) is 2-chloro-5-morpholin-4-ylsulfonyl-N-(2-phenylethyl)benzamide.
What is the SMILES notation for 2-chloro-5-morpholin-4-ylsulfonyl-N-(2-phenylethyl)benzamide?
The canonical SMILES for 2-chloro-5-morpholin-4-ylsulfonyl-N-(2-phenylethyl)benzamide is O=C(NCCc1ccccc1)c1cc(S(=O)(=O)N2CCOCC2)ccc1Cl.
What is the InChIKey of 2-chloro-5-morpholin-4-ylsulfonyl-N-(2-phenylethyl)benzamide?
The InChIKey is WHFZEAIWNLTHFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21ClN2O4S/c20-18-7-6-16(27(24,25)22-10-12-26-13-11-22)14-17(18)19(23)21-9-8-15-4-2-1-3-5-15/h1-7,14H,8-13H2,(H,21,23).
What are the key properties of 2-chloro-5-morpholin-4-ylsulfonyl-N-(2-phenylethyl)benzamide?
2-chloro-5-morpholin-4-ylsulfonyl-N-(2-phenylethyl)benzamide has a molecular weight of 408.91 g/mol, XLogP of 2.33, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-morpholin-4-ylsulfonyl-N-(2-phenylethyl)benzamide is sourced from PubChem (CID 27670888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).