N-(1,2-oxazol-4-yl)-4-piperidin-1-ylsulfonylbenzamide

C15H17N3O4S — CID 71797749

IUPACN-(1,2-oxazol-4-yl)-4-piperidin-1-ylsulfonylbenzamide
SMILESO=C(Nc1cnoc1)c1ccc(S(=O)(=O)N2CCCCC2)cc1
InChIInChI=1S/C15H17N3O4S/c19-15(17-13-10-16-22-11-13)12-4-6-14(7-5-12)23(20,21)18-8-2-1-3-9-18/h4-7,10-11H,1-3,8-9H2,(H,17,19)
InChIKeyVKEYHURNQAKMQP-UHFFFAOYSA-N
MW335.38 g/mol
LogP2.10
Rot. Bonds4

About N-(1,2-oxazol-4-yl)-4-piperidin-1-ylsulfonylbenzamide

N-(1,2-oxazol-4-yl)-4-piperidin-1-ylsulfonylbenzamide (PubChem CID 71797749) has the molecular formula C15H17N3O4S and a molecular weight of 335.38 g/mol. Its IUPAC name is N-(1,2-oxazol-4-yl)-4-piperidin-1-ylsulfonylbenzamide.

Molecular Properties

Compound NameN-(1,2-oxazol-4-yl)-4-piperidin-1-ylsulfonylbenzamide
PubChem CID71797749
Molecular FormulaC15H17N3O4S
Molecular Weight335.38 g/mol
Exact Mass335.09
IUPAC NameN-(1,2-oxazol-4-yl)-4-piperidin-1-ylsulfonylbenzamide
SMILESO=C(Nc1cnoc1)c1ccc(S(=O)(=O)N2CCCCC2)cc1
InChIInChI=1S/C15H17N3O4S/c19-15(17-13-10-16-22-11-13)12-4-6-14(7-5-12)23(20,21)18-8-2-1-3-9-18/h4-7,10-11H,1-3,8-9H2,(H,17,19)
InChIKeyVKEYHURNQAKMQP-UHFFFAOYSA-N
XLogP2.10
TPSA92.51 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.38
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-N,4-N-bis[4-(azepan-1-ylsulfonyl)phenyl]benzene-1,4-dicarboxamide
CID 5167539
4-pyrrolidin-1-ylsulfonyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide
CID 26252425
4-(azepan-1-ylsulfonyl)-N-[4-[4-[[4-(azepan-1-ylsulfonyl)benzoyl]amino]phenyl]phenyl]benzamide
CID 3537523
N-(4-fluorophenyl)-4-piperidin-1-ylsulfonylbenzamide
CID 2704882
N-(3,5-dimethylphenyl)-4-piperidin-1-ylsulfonylbenzamide
CID 2710141
N-(4-acetylphenyl)-4-pyrrolidin-1-ylsulfonylbenzamide
CID 650028
N-[3-(1,2-oxazol-4-yl)propyl]-4-pyrrolidin-1-ylsulfonylbenzamide
CID 91814425
4-(methanesulfonamido)-N-(4-piperidin-1-ylsulfonylphenyl)benzamide
CID 2978605
4-(azepan-1-ylsulfonyl)-N-[3-[[4-(azepan-1-ylsulfonyl)benzoyl]amino]-4-pyridinyl]benzamide
CID 3404667
N-(4-nitrophenyl)-4-piperidin-1-ylsulfonylbenzamide
CID 2965881
N-(4-ethylphenyl)-4-piperidin-1-ylsulfonylbenzamide
CID 26697285
4-(azepan-1-ylsulfonyl)-N-(3-hydroxyphenyl)benzamide
CID 992235

Frequently Asked Questions

What is the IUPAC name of N-(1,2-oxazol-4-yl)-4-piperidin-1-ylsulfonylbenzamide?
The IUPAC name of N-(1,2-oxazol-4-yl)-4-piperidin-1-ylsulfonylbenzamide (CID 71797749) is N-(1,2-oxazol-4-yl)-4-piperidin-1-ylsulfonylbenzamide.
What is the SMILES notation for N-(1,2-oxazol-4-yl)-4-piperidin-1-ylsulfonylbenzamide?
The canonical SMILES for N-(1,2-oxazol-4-yl)-4-piperidin-1-ylsulfonylbenzamide is O=C(Nc1cnoc1)c1ccc(S(=O)(=O)N2CCCCC2)cc1.
What is the InChIKey of N-(1,2-oxazol-4-yl)-4-piperidin-1-ylsulfonylbenzamide?
The InChIKey is VKEYHURNQAKMQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O4S/c19-15(17-13-10-16-22-11-13)12-4-6-14(7-5-12)23(20,21)18-8-2-1-3-9-18/h4-7,10-11H,1-3,8-9H2,(H,17,19).
What are the key properties of N-(1,2-oxazol-4-yl)-4-piperidin-1-ylsulfonylbenzamide?
N-(1,2-oxazol-4-yl)-4-piperidin-1-ylsulfonylbenzamide has a molecular weight of 335.38 g/mol, XLogP of 2.10, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,2-oxazol-4-yl)-4-piperidin-1-ylsulfonylbenzamide is sourced from PubChem (CID 71797749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).