N-ethyl-2-methyl-N-piperidin-4-yl-1,3-thiazole-4-carboxamide

C12H19N3OS — CID 65198571

IUPACN-ethyl-2-methyl-N-piperidin-4-yl-1,3-thiazole-4-carboxamide
SMILESCCN(C(=O)c1csc(C)n1)C1CCNCC1
InChIInChI=1S/C12H19N3OS/c1-3-15(10-4-6-13-7-5-10)12(16)11-8-17-9(2)14-11/h8,10,13H,3-7H2,1-2H3
InChIKeyXYZQDIWGMVRBRV-UHFFFAOYSA-N
MW253.37 g/mol
LogP1.67
Rot. Bonds3

About N-ethyl-2-methyl-N-piperidin-4-yl-1,3-thiazole-4-carboxamide

N-ethyl-2-methyl-N-piperidin-4-yl-1,3-thiazole-4-carboxamide (PubChem CID 65198571) has the molecular formula C12H19N3OS and a molecular weight of 253.37 g/mol. Its IUPAC name is N-ethyl-2-methyl-N-piperidin-4-yl-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound NameN-ethyl-2-methyl-N-piperidin-4-yl-1,3-thiazole-4-carboxamide
PubChem CID65198571
Molecular FormulaC12H19N3OS
Molecular Weight253.37 g/mol
Exact Mass253.12
IUPAC NameN-ethyl-2-methyl-N-piperidin-4-yl-1,3-thiazole-4-carboxamide
SMILESCCN(C(=O)c1csc(C)n1)C1CCNCC1
InChIInChI=1S/C12H19N3OS/c1-3-15(10-4-6-13-7-5-10)12(16)11-8-17-9(2)14-11/h8,10,13H,3-7H2,1-2H3
InChIKeyXYZQDIWGMVRBRV-UHFFFAOYSA-N
XLogP1.67
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.37
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-2-methyl-N-piperidin-3-yl-1,3-thiazole-4-carboxamide
CID 65198740
2-[ethyl(piperidin-4-yl)carbamoyl]-1,3-thiazole-4-carboxylic acid
CID 116696780
N-cyclobutyl-N-(2-hydroxyethyl)-2-methyl-1,3-thiazole-4-carboxamide
CID 102684996
N-ethyl-5-methyl-N-piperidin-4-yl-1,2-oxazole-3-carboxamide
CID 60805893
N-(2-chloroethyl)-N-cyclohexyl-2-methyl-1,3-thiazole-4-carboxamide
CID 65198822
N-ethyl-N-pyrrolidin-3-yl-1,3-thiazole-4-carboxamide
CID 63299155
N-piperidin-4-yl-N-propyl-2-pyridin-4-yl-1,3-thiazole-4-carboxamide
CID 166298535
N-ethyl-2,6-dimethyl-N-piperidin-4-ylpyridine-3-carboxamide
CID 62828526
N-[(4-aminophenyl)methyl]-N-cyclopropyl-2-methyl-1,3-thiazole-4-carboxamide
CID 65199839
2-benzyl-N-piperidin-4-yl-N-propyl-1,3-thiazole-4-carboxamide
CID 119823662
N-(3-amino-3-hydroxyiminopropyl)-N-cyclopropyl-2-methyl-1,3-thiazole-4-carboxamide
CID 77059342
4-chloro-N-ethyl-N-piperidin-4-ylbenzamide
CID 54923441

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-methyl-N-piperidin-4-yl-1,3-thiazole-4-carboxamide?
The IUPAC name of N-ethyl-2-methyl-N-piperidin-4-yl-1,3-thiazole-4-carboxamide (CID 65198571) is N-ethyl-2-methyl-N-piperidin-4-yl-1,3-thiazole-4-carboxamide.
What is the SMILES notation for N-ethyl-2-methyl-N-piperidin-4-yl-1,3-thiazole-4-carboxamide?
The canonical SMILES for N-ethyl-2-methyl-N-piperidin-4-yl-1,3-thiazole-4-carboxamide is CCN(C(=O)c1csc(C)n1)C1CCNCC1.
What is the InChIKey of N-ethyl-2-methyl-N-piperidin-4-yl-1,3-thiazole-4-carboxamide?
The InChIKey is XYZQDIWGMVRBRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3OS/c1-3-15(10-4-6-13-7-5-10)12(16)11-8-17-9(2)14-11/h8,10,13H,3-7H2,1-2H3.
What are the key properties of N-ethyl-2-methyl-N-piperidin-4-yl-1,3-thiazole-4-carboxamide?
N-ethyl-2-methyl-N-piperidin-4-yl-1,3-thiazole-4-carboxamide has a molecular weight of 253.37 g/mol, XLogP of 1.67, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-methyl-N-piperidin-4-yl-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 65198571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).