1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-N-(4-methyl-1,3-thiazol-2-yl)piperidine-4-carboxamide

C15H20N4O4S2 — CID 4301191

IUPAC1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-N-(4-methyl-1,3-thiazol-2-yl)piperidine-4-carboxamide
SMILESCc1csc(NC(=O)C2CCN(S(=O)(=O)c3c(C)noc3C)CC2)n1
InChIInChI=1S/C15H20N4O4S2/c1-9-8-24-15(16-9)17-14(20)12-4-6-19(7-5-12)25(21,22)13-10(2)18-23-11(13)3/h8,12H,4-7H2,1-3H3,(H,16,17,20)
InChIKeyGIIWNQXOENDNDS-UHFFFAOYSA-N
MW384.48 g/mol
LogP2.10
Rot. Bonds4

About 1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-N-(4-methyl-1,3-thiazol-2-yl)piperidine-4-carboxamide

1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-N-(4-methyl-1,3-thiazol-2-yl)piperidine-4-carboxamide (PubChem CID 4301191) has the molecular formula C15H20N4O4S2 and a molecular weight of 384.48 g/mol. Its IUPAC name is 1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-N-(4-methyl-1,3-thiazol-2-yl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-N-(4-methyl-1,3-thiazol-2-yl)piperidine-4-carboxamide
PubChem CID4301191
Molecular FormulaC15H20N4O4S2
Molecular Weight384.48 g/mol
Exact Mass384.09
IUPAC Name1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-N-(4-methyl-1,3-thiazol-2-yl)piperidine-4-carboxamide
SMILESCc1csc(NC(=O)C2CCN(S(=O)(=O)c3c(C)noc3C)CC2)n1
InChIInChI=1S/C15H20N4O4S2/c1-9-8-24-15(16-9)17-14(20)12-4-6-19(7-5-12)25(21,22)13-10(2)18-23-11(13)3/h8,12H,4-7H2,1-3H3,(H,16,17,20)
InChIKeyGIIWNQXOENDNDS-UHFFFAOYSA-N
XLogP2.10
TPSA105.40 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.48
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-N-(4-methyl-1,3-thiazol-2-yl)piperidine-4-carboxamide?
The IUPAC name of 1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-N-(4-methyl-1,3-thiazol-2-yl)piperidine-4-carboxamide (CID 4301191) is 1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-N-(4-methyl-1,3-thiazol-2-yl)piperidine-4-carboxamide.
What is the SMILES notation for 1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-N-(4-methyl-1,3-thiazol-2-yl)piperidine-4-carboxamide?
The canonical SMILES for 1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-N-(4-methyl-1,3-thiazol-2-yl)piperidine-4-carboxamide is Cc1csc(NC(=O)C2CCN(S(=O)(=O)c3c(C)noc3C)CC2)n1.
What is the InChIKey of 1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-N-(4-methyl-1,3-thiazol-2-yl)piperidine-4-carboxamide?
The InChIKey is GIIWNQXOENDNDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O4S2/c1-9-8-24-15(16-9)17-14(20)12-4-6-19(7-5-12)25(21,22)13-10(2)18-23-11(13)3/h8,12H,4-7H2,1-3H3,(H,16,17,20).
What are the key properties of 1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-N-(4-methyl-1,3-thiazol-2-yl)piperidine-4-carboxamide?
1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-N-(4-methyl-1,3-thiazol-2-yl)piperidine-4-carboxamide has a molecular weight of 384.48 g/mol, XLogP of 2.10, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-N-(4-methyl-1,3-thiazol-2-yl)piperidine-4-carboxamide is sourced from PubChem (CID 4301191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).