3-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]piperidine-3-carboxamide

C12H19N3OS — CID 63239889

IUPAC3-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]piperidine-3-carboxamide
SMILESCC1(C(=O)NCCc2nccs2)CCCNC1
InChIInChI=1S/C12H19N3OS/c1-12(4-2-5-13-9-12)11(16)15-6-3-10-14-7-8-17-10/h7-8,13H,2-6,9H2,1H3,(H,15,16)
InChIKeyNNNQANWMORRXCR-UHFFFAOYSA-N
MW253.37 g/mol
LogP1.19
Rot. Bonds4

About 3-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]piperidine-3-carboxamide

3-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]piperidine-3-carboxamide (PubChem CID 63239889) has the molecular formula C12H19N3OS and a molecular weight of 253.37 g/mol. Its IUPAC name is 3-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]piperidine-3-carboxamide.

Molecular Properties

Compound Name3-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]piperidine-3-carboxamide
PubChem CID63239889
Molecular FormulaC12H19N3OS
Molecular Weight253.37 g/mol
Exact Mass253.12
IUPAC Name3-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]piperidine-3-carboxamide
SMILESCC1(C(=O)NCCc2nccs2)CCCNC1
InChIInChI=1S/C12H19N3OS/c1-12(4-2-5-13-9-12)11(16)15-6-3-10-14-7-8-17-10/h7-8,13H,2-6,9H2,1H3,(H,15,16)
InChIKeyNNNQANWMORRXCR-UHFFFAOYSA-N
XLogP1.19
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.37
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]piperidine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]pyrrolidine-3-carboxamide
CID 63239936
3-propyl-N-[2-(1,3-thiazol-2-yl)ethyl]pyrrolidine-3-carboxamide
CID 55176192
(3S)-3-methyl-N-(1,3-thiazol-2-yl)piperidine-3-carboxamide
CID 129369013
3-methyl-N-(2-pyridin-2-ylethyl)piperidine-3-carboxamide;dihydrochloride
CID 119946078
3-methyl-N-(2-pyridin-3-ylethyl)piperidine-3-carboxamide;dihydrochloride
CID 119946421
3-methyl-N-[2-(2-methylphenyl)ethyl]piperidine-3-carboxamide
CID 79749345
3-methyl-N-(2-pyrrolidin-1-ylethyl)piperidine-3-carboxamide
CID 63130405
3-methyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidine-3-carboxamide
CID 55165281
3-propyl-N-(1,3-thiazol-2-ylmethyl)piperidine-3-carboxamide
CID 63134919
3-methyl-N-(pyridazin-3-ylmethyl)piperidine-3-carboxamide
CID 106896221
3-methyl-N-(3-phenoxypropyl)piperidine-3-carboxamide
CID 63133086
1-[2-[(3-methylpiperidine-3-carbonyl)amino]ethyl]imidazole-4-carboxylic acid
CID 107500460

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]piperidine-3-carboxamide?
The IUPAC name of 3-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]piperidine-3-carboxamide (CID 63239889) is 3-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]piperidine-3-carboxamide.
What is the SMILES notation for 3-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]piperidine-3-carboxamide?
The canonical SMILES for 3-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]piperidine-3-carboxamide is CC1(C(=O)NCCc2nccs2)CCCNC1.
What is the InChIKey of 3-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]piperidine-3-carboxamide?
The InChIKey is NNNQANWMORRXCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3OS/c1-12(4-2-5-13-9-12)11(16)15-6-3-10-14-7-8-17-10/h7-8,13H,2-6,9H2,1H3,(H,15,16).
What are the key properties of 3-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]piperidine-3-carboxamide?
3-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]piperidine-3-carboxamide has a molecular weight of 253.37 g/mol, XLogP of 1.19, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]piperidine-3-carboxamide is sourced from PubChem (CID 63239889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).