2-methylsulfonyl-N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]benzamide

C18H26N2O5S — CID 55642293

IUPAC2-methylsulfonyl-N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]benzamide
SMILESCS(=O)(=O)c1ccccc1C(=O)NCC(C1CCOC1)N1CCOCC1
InChIInChI=1S/C18H26N2O5S/c1-26(22,23)17-5-3-2-4-15(17)18(21)19-12-16(14-6-9-25-13-14)20-7-10-24-11-8-20/h2-5,14,16H,6-13H2,1H3,(H,19,21)
InChIKeyAJZQFGHVAHLAOL-UHFFFAOYSA-N
MW382.48 g/mol
LogP0.56
Rot. Bonds6

About 2-methylsulfonyl-N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]benzamide

2-methylsulfonyl-N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]benzamide (PubChem CID 55642293) has the molecular formula C18H26N2O5S and a molecular weight of 382.48 g/mol. Its IUPAC name is 2-methylsulfonyl-N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]benzamide.

Molecular Properties

Compound Name2-methylsulfonyl-N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]benzamide
PubChem CID55642293
Molecular FormulaC18H26N2O5S
Molecular Weight382.48 g/mol
Exact Mass382.16
IUPAC Name2-methylsulfonyl-N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]benzamide
SMILESCS(=O)(=O)c1ccccc1C(=O)NCC(C1CCOC1)N1CCOCC1
InChIInChI=1S/C18H26N2O5S/c1-26(22,23)17-5-3-2-4-15(17)18(21)19-12-16(14-6-9-25-13-14)20-7-10-24-11-8-20/h2-5,14,16H,6-13H2,1H3,(H,19,21)
InChIKeyAJZQFGHVAHLAOL-UHFFFAOYSA-N
XLogP0.56
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.48
LogP ≤ 50.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-methoxy-N-[(2R)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]pyridine-3-carboxamide
CID 94024269
2,5-dimethyl-N-[(2S)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]thiophene-3-carboxamide
CID 94083341
N-[(2S)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]thiophene-2-carboxamide
CID 94083431
(2S)-N-[(2S)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]-2-phenylbutanamide
CID 94150246
1,5-dimethyl-N-[(2S)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]pyrazole-4-carboxamide
CID 94021725
1,5-dimethyl-N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]pyrazole-4-carboxamide
CID 94021723
(2S)-2-(benzenesulfonamido)-N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]propanamide
CID 55938397
N-[(2S)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]quinoline-2-carboxamide
CID 94083483
2-(4-methylphenyl)-N-[(2R)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]acetamide
CID 94150138
N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]-2-(5-phenyl-1,3-oxazol-2-yl)benzamide
CID 52582079
5-ethyl-N-[(2S)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]thiophene-2-carboxamide
CID 94021730
3-(cyclopropylsulfamoyl)-N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]benzamide
CID 55642118

Frequently Asked Questions

What is the IUPAC name of 2-methylsulfonyl-N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]benzamide?
The IUPAC name of 2-methylsulfonyl-N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]benzamide (CID 55642293) is 2-methylsulfonyl-N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]benzamide.
What is the SMILES notation for 2-methylsulfonyl-N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]benzamide?
The canonical SMILES for 2-methylsulfonyl-N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]benzamide is CS(=O)(=O)c1ccccc1C(=O)NCC(C1CCOC1)N1CCOCC1.
What is the InChIKey of 2-methylsulfonyl-N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]benzamide?
The InChIKey is AJZQFGHVAHLAOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O5S/c1-26(22,23)17-5-3-2-4-15(17)18(21)19-12-16(14-6-9-25-13-14)20-7-10-24-11-8-20/h2-5,14,16H,6-13H2,1H3,(H,19,21).
What are the key properties of 2-methylsulfonyl-N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]benzamide?
2-methylsulfonyl-N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]benzamide has a molecular weight of 382.48 g/mol, XLogP of 0.56, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylsulfonyl-N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]benzamide is sourced from PubChem (CID 55642293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).