N-piperidin-3-yl-2-piperidin-1-ylsulfonylbenzamide

C17H25N3O3S — CID 119425802

IUPACN-piperidin-3-yl-2-piperidin-1-ylsulfonylbenzamide
SMILESO=C(NC1CCCNC1)c1ccccc1S(=O)(=O)N1CCCCC1
InChIInChI=1S/C17H25N3O3S/c21-17(19-14-7-6-10-18-13-14)15-8-2-3-9-16(15)24(22,23)20-11-4-1-5-12-20/h2-3,8-9,14,18H,1,4-7,10-13H2,(H,19,21)
InChIKeyJERLOYCIPIKABJ-UHFFFAOYSA-N
MW351.47 g/mol
LogP1.34
Rot. Bonds4

About N-piperidin-3-yl-2-piperidin-1-ylsulfonylbenzamide

N-piperidin-3-yl-2-piperidin-1-ylsulfonylbenzamide (PubChem CID 119425802) has the molecular formula C17H25N3O3S and a molecular weight of 351.47 g/mol. Its IUPAC name is N-piperidin-3-yl-2-piperidin-1-ylsulfonylbenzamide.

Molecular Properties

Compound NameN-piperidin-3-yl-2-piperidin-1-ylsulfonylbenzamide
PubChem CID119425802
Molecular FormulaC17H25N3O3S
Molecular Weight351.47 g/mol
Exact Mass351.16
IUPAC NameN-piperidin-3-yl-2-piperidin-1-ylsulfonylbenzamide
SMILESO=C(NC1CCCNC1)c1ccccc1S(=O)(=O)N1CCCCC1
InChIInChI=1S/C17H25N3O3S/c21-17(19-14-7-6-10-18-13-14)15-8-2-3-9-16(15)24(22,23)20-11-4-1-5-12-20/h2-3,8-9,14,18H,1,4-7,10-13H2,(H,19,21)
InChIKeyJERLOYCIPIKABJ-UHFFFAOYSA-N
XLogP1.34
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.47
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-morpholin-4-ylsulfonyl-N-piperidin-3-ylbenzamide;hydrochloride
CID 119427667
N-piperidin-3-yl-2-pyrrolidin-1-ylsulfonylbenzenesulfonamide
CID 120707123
2-methylsulfonyl-N-pyrrolidin-3-ylbenzamide
CID 119450814
3-(azepan-1-ylsulfonyl)-4-methoxy-N-piperidin-3-ylbenzamide;hydrochloride
CID 119426236
2-amino-N-piperidin-3-ylbenzamide
CID 70159342
5-methyl-N-piperidin-3-yl-4-pyrrolidin-1-ylsulfonylfuran-2-carboxamide
CID 119425165
2-piperidin-1-yl-N-piperidin-3-ylpyridine-3-carboxamide;dihydrochloride
CID 119426882
N-(2-hydroxyethyl)-2-piperidin-1-ylsulfonylbenzamide
CID 78794594
2,3-dihydroxy-N-piperidin-3-ylbenzamide
CID 114343480
N-piperidin-3-yl-2-(4-piperidin-1-ylsulfonylphenyl)acetamide;hydrochloride
CID 119425534
N-pyrrolidin-3-yl-2-pyrrolidin-1-ylsulfonylbenzenesulfonamide;hydrochloride
CID 120707575
N-piperidin-3-yl-2-pyrrolidin-1-ylpyridine-3-carboxamide;dihydrochloride
CID 119427810

Frequently Asked Questions

What is the IUPAC name of N-piperidin-3-yl-2-piperidin-1-ylsulfonylbenzamide?
The IUPAC name of N-piperidin-3-yl-2-piperidin-1-ylsulfonylbenzamide (CID 119425802) is N-piperidin-3-yl-2-piperidin-1-ylsulfonylbenzamide.
What is the SMILES notation for N-piperidin-3-yl-2-piperidin-1-ylsulfonylbenzamide?
The canonical SMILES for N-piperidin-3-yl-2-piperidin-1-ylsulfonylbenzamide is O=C(NC1CCCNC1)c1ccccc1S(=O)(=O)N1CCCCC1.
What is the InChIKey of N-piperidin-3-yl-2-piperidin-1-ylsulfonylbenzamide?
The InChIKey is JERLOYCIPIKABJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O3S/c21-17(19-14-7-6-10-18-13-14)15-8-2-3-9-16(15)24(22,23)20-11-4-1-5-12-20/h2-3,8-9,14,18H,1,4-7,10-13H2,(H,19,21).
What are the key properties of N-piperidin-3-yl-2-piperidin-1-ylsulfonylbenzamide?
N-piperidin-3-yl-2-piperidin-1-ylsulfonylbenzamide has a molecular weight of 351.47 g/mol, XLogP of 1.34, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-piperidin-3-yl-2-piperidin-1-ylsulfonylbenzamide is sourced from PubChem (CID 119425802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).