4-[5-(3,5-dimethyl-1,2-oxazol-4-yl)pyrazin-2-yl]-N,N-dimethylpiperidine-1-sulfonamide

C16H23N5O3S — CID 110158985

IUPAC4-[5-(3,5-dimethyl-1,2-oxazol-4-yl)pyrazin-2-yl]-N,N-dimethylpiperidine-1-sulfonamide
SMILESCc1noc(C)c1-c1cnc(C2CCN(S(=O)(=O)N(C)C)CC2)cn1
InChIInChI=1S/C16H23N5O3S/c1-11-16(12(2)24-19-11)15-10-17-14(9-18-15)13-5-7-21(8-6-13)25(22,23)20(3)4/h9-10,13H,5-8H2,1-4H3
InChIKeyNGSKIHCUPYEYPE-UHFFFAOYSA-N
MW365.46 g/mol
LogP1.73
Rot. Bonds4

About 4-[5-(3,5-dimethyl-1,2-oxazol-4-yl)pyrazin-2-yl]-N,N-dimethylpiperidine-1-sulfonamide

4-[5-(3,5-dimethyl-1,2-oxazol-4-yl)pyrazin-2-yl]-N,N-dimethylpiperidine-1-sulfonamide (PubChem CID 110158985) has the molecular formula C16H23N5O3S and a molecular weight of 365.46 g/mol. Its IUPAC name is 4-[5-(3,5-dimethyl-1,2-oxazol-4-yl)pyrazin-2-yl]-N,N-dimethylpiperidine-1-sulfonamide.

Molecular Properties

Compound Name4-[5-(3,5-dimethyl-1,2-oxazol-4-yl)pyrazin-2-yl]-N,N-dimethylpiperidine-1-sulfonamide
PubChem CID110158985
Molecular FormulaC16H23N5O3S
Molecular Weight365.46 g/mol
Exact Mass365.15
IUPAC Name4-[5-(3,5-dimethyl-1,2-oxazol-4-yl)pyrazin-2-yl]-N,N-dimethylpiperidine-1-sulfonamide
SMILESCc1noc(C)c1-c1cnc(C2CCN(S(=O)(=O)N(C)C)CC2)cn1
InChIInChI=1S/C16H23N5O3S/c1-11-16(12(2)24-19-11)15-10-17-14(9-18-15)13-5-7-21(8-6-13)25(22,23)20(3)4/h9-10,13H,5-8H2,1-4H3
InChIKeyNGSKIHCUPYEYPE-UHFFFAOYSA-N
XLogP1.73
TPSA92.43 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.46
LogP ≤ 51.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-[5-(3,5-dimethyl-1,2-oxazol-4-yl)pyrazin-2-yl]-N,N-dimethylpiperidine-1-sulfonamide?
The IUPAC name of 4-[5-(3,5-dimethyl-1,2-oxazol-4-yl)pyrazin-2-yl]-N,N-dimethylpiperidine-1-sulfonamide (CID 110158985) is 4-[5-(3,5-dimethyl-1,2-oxazol-4-yl)pyrazin-2-yl]-N,N-dimethylpiperidine-1-sulfonamide.
What is the SMILES notation for 4-[5-(3,5-dimethyl-1,2-oxazol-4-yl)pyrazin-2-yl]-N,N-dimethylpiperidine-1-sulfonamide?
The canonical SMILES for 4-[5-(3,5-dimethyl-1,2-oxazol-4-yl)pyrazin-2-yl]-N,N-dimethylpiperidine-1-sulfonamide is Cc1noc(C)c1-c1cnc(C2CCN(S(=O)(=O)N(C)C)CC2)cn1.
What is the InChIKey of 4-[5-(3,5-dimethyl-1,2-oxazol-4-yl)pyrazin-2-yl]-N,N-dimethylpiperidine-1-sulfonamide?
The InChIKey is NGSKIHCUPYEYPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N5O3S/c1-11-16(12(2)24-19-11)15-10-17-14(9-18-15)13-5-7-21(8-6-13)25(22,23)20(3)4/h9-10,13H,5-8H2,1-4H3.
What are the key properties of 4-[5-(3,5-dimethyl-1,2-oxazol-4-yl)pyrazin-2-yl]-N,N-dimethylpiperidine-1-sulfonamide?
4-[5-(3,5-dimethyl-1,2-oxazol-4-yl)pyrazin-2-yl]-N,N-dimethylpiperidine-1-sulfonamide has a molecular weight of 365.46 g/mol, XLogP of 1.73, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-(3,5-dimethyl-1,2-oxazol-4-yl)pyrazin-2-yl]-N,N-dimethylpiperidine-1-sulfonamide is sourced from PubChem (CID 110158985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).