1-[4-hydroxy-5-(2-oxoindol-3-yl)-1,3-thiazol-2-yl]piperidine-4-carboxamide

C17H16N4O3S — CID 1285299

IUPAC1-[4-hydroxy-5-(2-oxoindol-3-yl)-1,3-thiazol-2-yl]piperidine-4-carboxamide
SMILESNC(=O)C1CCN(c2nc(O)c(C3=c4ccccc4=NC3=O)s2)CC1
InChIInChI=1S/C17H16N4O3S/c18-14(22)9-5-7-21(8-6-9)17-20-16(24)13(25-17)12-10-3-1-2-4-11(10)19-15(12)23/h1-4,9,24H,5-8H2,(H2,18,22)
InChIKeyTULGSBXYIFPDCM-UHFFFAOYSA-N
MW356.41 g/mol
LogP-0.09
Rot. Bonds3

About 1-[4-hydroxy-5-(2-oxoindol-3-yl)-1,3-thiazol-2-yl]piperidine-4-carboxamide

1-[4-hydroxy-5-(2-oxoindol-3-yl)-1,3-thiazol-2-yl]piperidine-4-carboxamide (PubChem CID 1285299) has the molecular formula C17H16N4O3S and a molecular weight of 356.41 g/mol. Its IUPAC name is 1-[4-hydroxy-5-(2-oxoindol-3-yl)-1,3-thiazol-2-yl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-[4-hydroxy-5-(2-oxoindol-3-yl)-1,3-thiazol-2-yl]piperidine-4-carboxamide
PubChem CID1285299
Molecular FormulaC17H16N4O3S
Molecular Weight356.41 g/mol
Exact Mass356.09
IUPAC Name1-[4-hydroxy-5-(2-oxoindol-3-yl)-1,3-thiazol-2-yl]piperidine-4-carboxamide
SMILESNC(=O)C1CCN(c2nc(O)c(C3=c4ccccc4=NC3=O)s2)CC1
InChIInChI=1S/C17H16N4O3S/c18-14(22)9-5-7-21(8-6-9)17-20-16(24)13(25-17)12-10-3-1-2-4-11(10)19-15(12)23/h1-4,9,24H,5-8H2,(H2,18,22)
InChIKeyTULGSBXYIFPDCM-UHFFFAOYSA-N
XLogP-0.09
TPSA108.88 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.41
LogP ≤ 5-0.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-[4-hydroxy-5-(2-oxoindol-3-yl)-1,3-thiazol-2-yl]piperidine-4-carboxamide?
The IUPAC name of 1-[4-hydroxy-5-(2-oxoindol-3-yl)-1,3-thiazol-2-yl]piperidine-4-carboxamide (CID 1285299) is 1-[4-hydroxy-5-(2-oxoindol-3-yl)-1,3-thiazol-2-yl]piperidine-4-carboxamide.
What is the SMILES notation for 1-[4-hydroxy-5-(2-oxoindol-3-yl)-1,3-thiazol-2-yl]piperidine-4-carboxamide?
The canonical SMILES for 1-[4-hydroxy-5-(2-oxoindol-3-yl)-1,3-thiazol-2-yl]piperidine-4-carboxamide is NC(=O)C1CCN(c2nc(O)c(C3=c4ccccc4=NC3=O)s2)CC1.
What is the InChIKey of 1-[4-hydroxy-5-(2-oxoindol-3-yl)-1,3-thiazol-2-yl]piperidine-4-carboxamide?
The InChIKey is TULGSBXYIFPDCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4O3S/c18-14(22)9-5-7-21(8-6-9)17-20-16(24)13(25-17)12-10-3-1-2-4-11(10)19-15(12)23/h1-4,9,24H,5-8H2,(H2,18,22).
What are the key properties of 1-[4-hydroxy-5-(2-oxoindol-3-yl)-1,3-thiazol-2-yl]piperidine-4-carboxamide?
1-[4-hydroxy-5-(2-oxoindol-3-yl)-1,3-thiazol-2-yl]piperidine-4-carboxamide has a molecular weight of 356.41 g/mol, XLogP of -0.09, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-hydroxy-5-(2-oxoindol-3-yl)-1,3-thiazol-2-yl]piperidine-4-carboxamide is sourced from PubChem (CID 1285299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).