3-hydroxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)piperidine-1-carboxamide

C12H19N3O2S — CID 22559661

IUPAC3-hydroxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)piperidine-1-carboxamide
SMILESCC(C)c1cnc(NC(=O)N2CCCC(O)C2)s1
InChIInChI=1S/C12H19N3O2S/c1-8(2)10-6-13-11(18-10)14-12(17)15-5-3-4-9(16)7-15/h6,8-9,16H,3-5,7H2,1-2H3,(H,13,14,17)
InChIKeyZXQQDCXGFTZHNO-UHFFFAOYSA-N
MW269.37 g/mol
LogP2.26
Rot. Bonds2

About 3-hydroxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)piperidine-1-carboxamide

3-hydroxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)piperidine-1-carboxamide (PubChem CID 22559661) has the molecular formula C12H19N3O2S and a molecular weight of 269.37 g/mol. Its IUPAC name is 3-hydroxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)piperidine-1-carboxamide.

Molecular Properties

Compound Name3-hydroxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)piperidine-1-carboxamide
PubChem CID22559661
Molecular FormulaC12H19N3O2S
Molecular Weight269.37 g/mol
Exact Mass269.12
IUPAC Name3-hydroxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)piperidine-1-carboxamide
SMILESCC(C)c1cnc(NC(=O)N2CCCC(O)C2)s1
InChIInChI=1S/C12H19N3O2S/c1-8(2)10-6-13-11(18-10)14-12(17)15-5-3-4-9(16)7-15/h6,8-9,16H,3-5,7H2,1-2H3,(H,13,14,17)
InChIKeyZXQQDCXGFTZHNO-UHFFFAOYSA-N
XLogP2.26
TPSA65.46 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.37
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)piperidine-1-carboxamide?
The IUPAC name of 3-hydroxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)piperidine-1-carboxamide (CID 22559661) is 3-hydroxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)piperidine-1-carboxamide.
What is the SMILES notation for 3-hydroxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)piperidine-1-carboxamide?
The canonical SMILES for 3-hydroxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)piperidine-1-carboxamide is CC(C)c1cnc(NC(=O)N2CCCC(O)C2)s1.
What is the InChIKey of 3-hydroxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)piperidine-1-carboxamide?
The InChIKey is ZXQQDCXGFTZHNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2S/c1-8(2)10-6-13-11(18-10)14-12(17)15-5-3-4-9(16)7-15/h6,8-9,16H,3-5,7H2,1-2H3,(H,13,14,17).
What are the key properties of 3-hydroxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)piperidine-1-carboxamide?
3-hydroxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)piperidine-1-carboxamide has a molecular weight of 269.37 g/mol, XLogP of 2.26, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)piperidine-1-carboxamide is sourced from PubChem (CID 22559661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).