2-morpholin-4-ylsulfonyl-N-piperidin-3-ylbenzamide;hydrochloride

C16H24ClN3O4S — CID 119427667

IUPAC2-morpholin-4-ylsulfonyl-N-piperidin-3-ylbenzamide;hydrochloride
SMILESCl.O=C(NC1CCCNC1)c1ccccc1S(=O)(=O)N1CCOCC1
InChIInChI=1S/C16H23N3O4S.ClH/c20-16(18-13-4-3-7-17-12-13)14-5-1-2-6-15(14)24(21,22)19-8-10-23-11-9-19;/h1-2,5-6,13,17H,3-4,7-12H2,(H,18,20);1H
InChIKeyOSUYDCVDNLQIRO-UHFFFAOYSA-N
MW389.91 g/mol
LogP0.61
Rot. Bonds4

About 2-morpholin-4-ylsulfonyl-N-piperidin-3-ylbenzamide;hydrochloride

2-morpholin-4-ylsulfonyl-N-piperidin-3-ylbenzamide;hydrochloride (PubChem CID 119427667) has the molecular formula C16H24ClN3O4S and a molecular weight of 389.91 g/mol. Its IUPAC name is 2-morpholin-4-ylsulfonyl-N-piperidin-3-ylbenzamide;hydrochloride.

Molecular Properties

Compound Name2-morpholin-4-ylsulfonyl-N-piperidin-3-ylbenzamide;hydrochloride
PubChem CID119427667
Molecular FormulaC16H24ClN3O4S
Molecular Weight389.91 g/mol
Exact Mass389.12
IUPAC Name2-morpholin-4-ylsulfonyl-N-piperidin-3-ylbenzamide;hydrochloride
SMILESCl.O=C(NC1CCCNC1)c1ccccc1S(=O)(=O)N1CCOCC1
InChIInChI=1S/C16H23N3O4S.ClH/c20-16(18-13-4-3-7-17-12-13)14-5-1-2-6-15(14)24(21,22)19-8-10-23-11-9-19;/h1-2,5-6,13,17H,3-4,7-12H2,(H,18,20);1H
InChIKeyOSUYDCVDNLQIRO-UHFFFAOYSA-N
XLogP0.61
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.91
LogP ≤ 50.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-piperidin-3-yl-2-piperidin-1-ylsulfonylbenzamide
CID 119425802
4-[(2-morpholin-4-ylsulfonylbenzoyl)amino]cyclohexane-1-carboxylic acid
CID 119229583
2-morpholin-4-ylsulfonylbenzohydrazide
CID 71258107
(2-morpholin-4-ylsulfonylphenyl)-piperazin-1-ylmethanone;hydrochloride
CID 119402696
2-methylsulfonyl-N-pyrrolidin-3-ylbenzamide
CID 119450814
1,4-diazepan-1-yl-(2-morpholin-4-ylsulfonylphenyl)methanone
CID 119417300
2-amino-N-piperidin-3-ylbenzamide
CID 70159342
2-morpholin-4-yl-N-piperidin-3-yl-5-sulfamoylbenzamide;dihydrochloride
CID 119428703
N-(4-iodophenyl)-2-morpholin-4-ylsulfonylbenzamide
CID 39892592
2-methoxy-5-morpholin-4-ylsulfonyl-N-pyrrolidin-3-ylbenzamide
CID 119450765
N-(3-aminopropyl)-2-morpholin-4-ylsulfonylbenzamide
CID 119407704
2,3-difluoro-N-piperidin-3-ylbenzamide;hydrochloride
CID 119428838

Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-ylsulfonyl-N-piperidin-3-ylbenzamide;hydrochloride?
The IUPAC name of 2-morpholin-4-ylsulfonyl-N-piperidin-3-ylbenzamide;hydrochloride (CID 119427667) is 2-morpholin-4-ylsulfonyl-N-piperidin-3-ylbenzamide;hydrochloride.
What is the SMILES notation for 2-morpholin-4-ylsulfonyl-N-piperidin-3-ylbenzamide;hydrochloride?
The canonical SMILES for 2-morpholin-4-ylsulfonyl-N-piperidin-3-ylbenzamide;hydrochloride is Cl.O=C(NC1CCCNC1)c1ccccc1S(=O)(=O)N1CCOCC1.
What is the InChIKey of 2-morpholin-4-ylsulfonyl-N-piperidin-3-ylbenzamide;hydrochloride?
The InChIKey is OSUYDCVDNLQIRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O4S.ClH/c20-16(18-13-4-3-7-17-12-13)14-5-1-2-6-15(14)24(21,22)19-8-10-23-11-9-19;/h1-2,5-6,13,17H,3-4,7-12H2,(H,18,20);1H.
What are the key properties of 2-morpholin-4-ylsulfonyl-N-piperidin-3-ylbenzamide;hydrochloride?
2-morpholin-4-ylsulfonyl-N-piperidin-3-ylbenzamide;hydrochloride has a molecular weight of 389.91 g/mol, XLogP of 0.61, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-ylsulfonyl-N-piperidin-3-ylbenzamide;hydrochloride is sourced from PubChem (CID 119427667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).