2-methoxy-5-morpholin-4-ylsulfonyl-N-pyrrolidin-3-ylbenzamide

C16H23N3O5S — CID 119450765

IUPAC2-methoxy-5-morpholin-4-ylsulfonyl-N-pyrrolidin-3-ylbenzamide
SMILESCOc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NC1CCNC1
InChIInChI=1S/C16H23N3O5S/c1-23-15-3-2-13(25(21,22)19-6-8-24-9-7-19)10-14(15)16(20)18-12-4-5-17-11-12/h2-3,10,12,17H,4-9,11H2,1H3,(H,18,20)
InChIKeyQIUVVNNPOBRKNA-UHFFFAOYSA-N
MW369.44 g/mol
LogP-0.19
Rot. Bonds5

About 2-methoxy-5-morpholin-4-ylsulfonyl-N-pyrrolidin-3-ylbenzamide

2-methoxy-5-morpholin-4-ylsulfonyl-N-pyrrolidin-3-ylbenzamide (PubChem CID 119450765) has the molecular formula C16H23N3O5S and a molecular weight of 369.44 g/mol. Its IUPAC name is 2-methoxy-5-morpholin-4-ylsulfonyl-N-pyrrolidin-3-ylbenzamide.

Molecular Properties

Compound Name2-methoxy-5-morpholin-4-ylsulfonyl-N-pyrrolidin-3-ylbenzamide
PubChem CID119450765
Molecular FormulaC16H23N3O5S
Molecular Weight369.44 g/mol
Exact Mass369.14
IUPAC Name2-methoxy-5-morpholin-4-ylsulfonyl-N-pyrrolidin-3-ylbenzamide
SMILESCOc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NC1CCNC1
InChIInChI=1S/C16H23N3O5S/c1-23-15-3-2-13(25(21,22)19-6-8-24-9-7-19)10-14(15)16(20)18-12-4-5-17-11-12/h2-3,10,12,17H,4-9,11H2,1H3,(H,18,20)
InChIKeyQIUVVNNPOBRKNA-UHFFFAOYSA-N
XLogP-0.19
TPSA96.97 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.44
LogP ≤ 5-0.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-cyclopropyl-2-methoxy-5-morpholin-4-ylsulfonylbenzamide
CID 26736864
5-(azepan-1-ylsulfonyl)-2-methoxy-N-pyrrolidin-3-ylbenzamide
CID 119450981
2-methoxy-N-(3-methylpiperidin-4-yl)-5-morpholin-4-ylsulfonylbenzamide
CID 120556774
N-[1-(2-ethylbutanoyl)piperidin-4-yl]-2-methoxy-5-morpholin-4-ylsulfonylbenzamide
CID 55949750
N-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]-2-methoxy-5-morpholin-4-ylsulfonylbenzamide
CID 125144986
N-cyclooctyl-2-methoxy-5-pyrrolidin-1-ylsulfonylbenzamide
CID 28590964
N-(3,4-dihydro-2H-chromen-4-yl)-2-methoxy-5-morpholin-4-ylsulfonylbenzamide
CID 16561402
N-(2,4-dimethylpentan-3-yl)-2-methoxy-5-morpholin-4-ylsulfonylbenzamide
CID 28591079
N-[2-(ethylamino)ethyl]-2-methoxy-5-morpholin-4-ylsulfonylbenzamide
CID 119505913
N-(2-chlorophenyl)-2-methoxy-5-morpholin-4-ylsulfonylbenzamide
CID 18195774
2-methoxy-5-morpholin-4-ylsulfonyl-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]benzamide
CID 28570089
2-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)-N-pyrrolidin-3-ylacetamide;hydrochloride
CID 119453904

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-5-morpholin-4-ylsulfonyl-N-pyrrolidin-3-ylbenzamide?
The IUPAC name of 2-methoxy-5-morpholin-4-ylsulfonyl-N-pyrrolidin-3-ylbenzamide (CID 119450765) is 2-methoxy-5-morpholin-4-ylsulfonyl-N-pyrrolidin-3-ylbenzamide.
What is the SMILES notation for 2-methoxy-5-morpholin-4-ylsulfonyl-N-pyrrolidin-3-ylbenzamide?
The canonical SMILES for 2-methoxy-5-morpholin-4-ylsulfonyl-N-pyrrolidin-3-ylbenzamide is COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NC1CCNC1.
What is the InChIKey of 2-methoxy-5-morpholin-4-ylsulfonyl-N-pyrrolidin-3-ylbenzamide?
The InChIKey is QIUVVNNPOBRKNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O5S/c1-23-15-3-2-13(25(21,22)19-6-8-24-9-7-19)10-14(15)16(20)18-12-4-5-17-11-12/h2-3,10,12,17H,4-9,11H2,1H3,(H,18,20).
What are the key properties of 2-methoxy-5-morpholin-4-ylsulfonyl-N-pyrrolidin-3-ylbenzamide?
2-methoxy-5-morpholin-4-ylsulfonyl-N-pyrrolidin-3-ylbenzamide has a molecular weight of 369.44 g/mol, XLogP of -0.19, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-5-morpholin-4-ylsulfonyl-N-pyrrolidin-3-ylbenzamide is sourced from PubChem (CID 119450765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).