1-acetyl-N-(4-cyclopropyl-1,3-thiazol-2-yl)piperidine-4-carboxamide

C14H19N3O2S — CID 32864406

IUPAC1-acetyl-N-(4-cyclopropyl-1,3-thiazol-2-yl)piperidine-4-carboxamide
SMILESCC(=O)N1CCC(C(=O)Nc2nc(C3CC3)cs2)CC1
InChIInChI=1S/C14H19N3O2S/c1-9(18)17-6-4-11(5-7-17)13(19)16-14-15-12(8-20-14)10-2-3-10/h8,10-11H,2-7H2,1H3,(H,15,16,19)
InChIKeyIURWTABLSOMGIE-UHFFFAOYSA-N
MW293.39 g/mol
LogP2.22
Rot. Bonds3

About 1-acetyl-N-(4-cyclopropyl-1,3-thiazol-2-yl)piperidine-4-carboxamide

1-acetyl-N-(4-cyclopropyl-1,3-thiazol-2-yl)piperidine-4-carboxamide (PubChem CID 32864406) has the molecular formula C14H19N3O2S and a molecular weight of 293.39 g/mol. Its IUPAC name is 1-acetyl-N-(4-cyclopropyl-1,3-thiazol-2-yl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-acetyl-N-(4-cyclopropyl-1,3-thiazol-2-yl)piperidine-4-carboxamide
PubChem CID32864406
Molecular FormulaC14H19N3O2S
Molecular Weight293.39 g/mol
Exact Mass293.12
IUPAC Name1-acetyl-N-(4-cyclopropyl-1,3-thiazol-2-yl)piperidine-4-carboxamide
SMILESCC(=O)N1CCC(C(=O)Nc2nc(C3CC3)cs2)CC1
InChIInChI=1S/C14H19N3O2S/c1-9(18)17-6-4-11(5-7-17)13(19)16-14-15-12(8-20-14)10-2-3-10/h8,10-11H,2-7H2,1H3,(H,15,16,19)
InChIKeyIURWTABLSOMGIE-UHFFFAOYSA-N
XLogP2.22
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.39
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-acetyl-N-(4-cyclopropyl-1,3-thiazol-2-yl)piperidine-4-carboxamide?
The IUPAC name of 1-acetyl-N-(4-cyclopropyl-1,3-thiazol-2-yl)piperidine-4-carboxamide (CID 32864406) is 1-acetyl-N-(4-cyclopropyl-1,3-thiazol-2-yl)piperidine-4-carboxamide.
What is the SMILES notation for 1-acetyl-N-(4-cyclopropyl-1,3-thiazol-2-yl)piperidine-4-carboxamide?
The canonical SMILES for 1-acetyl-N-(4-cyclopropyl-1,3-thiazol-2-yl)piperidine-4-carboxamide is CC(=O)N1CCC(C(=O)Nc2nc(C3CC3)cs2)CC1.
What is the InChIKey of 1-acetyl-N-(4-cyclopropyl-1,3-thiazol-2-yl)piperidine-4-carboxamide?
The InChIKey is IURWTABLSOMGIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2S/c1-9(18)17-6-4-11(5-7-17)13(19)16-14-15-12(8-20-14)10-2-3-10/h8,10-11H,2-7H2,1H3,(H,15,16,19).
What are the key properties of 1-acetyl-N-(4-cyclopropyl-1,3-thiazol-2-yl)piperidine-4-carboxamide?
1-acetyl-N-(4-cyclopropyl-1,3-thiazol-2-yl)piperidine-4-carboxamide has a molecular weight of 293.39 g/mol, XLogP of 2.22, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-acetyl-N-(4-cyclopropyl-1,3-thiazol-2-yl)piperidine-4-carboxamide is sourced from PubChem (CID 32864406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).