ethyl 1-(1,3-thiazol-2-yl)piperidine-4-carboxylate

C11H16N2O2S — CID 60658779

IUPACethyl 1-(1,3-thiazol-2-yl)piperidine-4-carboxylate
SMILESCCOC(=O)C1CCN(c2nccs2)CC1
InChIInChI=1S/C11H16N2O2S/c1-2-15-10(14)9-3-6-13(7-4-9)11-12-5-8-16-11/h5,8-9H,2-4,6-7H2,1H3
InChIKeyZZCNNRSAQYOGGU-UHFFFAOYSA-N
MW240.33 g/mol
LogP1.92
Rot. Bonds3

About ethyl 1-(1,3-thiazol-2-yl)piperidine-4-carboxylate

ethyl 1-(1,3-thiazol-2-yl)piperidine-4-carboxylate (PubChem CID 60658779) has the molecular formula C11H16N2O2S and a molecular weight of 240.33 g/mol. Its IUPAC name is ethyl 1-(1,3-thiazol-2-yl)piperidine-4-carboxylate.

Molecular Properties

Compound Nameethyl 1-(1,3-thiazol-2-yl)piperidine-4-carboxylate
PubChem CID60658779
Molecular FormulaC11H16N2O2S
Molecular Weight240.33 g/mol
Exact Mass240.09
IUPAC Nameethyl 1-(1,3-thiazol-2-yl)piperidine-4-carboxylate
SMILESCCOC(=O)C1CCN(c2nccs2)CC1
InChIInChI=1S/C11H16N2O2S/c1-2-15-10(14)9-3-6-13(7-4-9)11-12-5-8-16-11/h5,8-9H,2-4,6-7H2,1H3
InChIKeyZZCNNRSAQYOGGU-UHFFFAOYSA-N
XLogP1.92
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.33
LogP ≤ 51.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze ethyl 1-(1,3-thiazol-2-yl)piperidine-4-carboxylate 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

1-(1,3-Thiazol-2-yl)piperidine-4-carboxylic acid
CID 7131626
1-(2-Methoxyethyl)-9-(1,3-thiazol-2-yl)-4-oxa-1,9-diazaspiro[5.5]undecane
CID 97396284
1-(1,3-Thiazol-2-yl)piperidine-4-carboxylic acid hydrochloride
CID 54593164
1-Ethyl-9-(1,3-thiazol-2-yl)-4-oxa-1,9-diazaspiro[5.5]undecane;2,2,2-trifluoroacetic acid
CID 118744726
Ethyl 1-[5-(trifluoromethyl)-1,3-thiazol-2-yl]piperidine-4-carboxylate
CID 133521963
ethyl (3S)-1-(1,3-thiazol-2-yl)piperidine-3-carboxylate
CID 53663766
(2-Amino-2-oxoethyl) 3-[1-(1,3-thiazol-2-yl)piperidin-4-yl]propanoate
CID 58032804
Ethyl 1-[2-[(2-amino-1,3-thiazol-5-yl)sulfanyl]ethyl]piperidine-4-carboxylate
CID 58328477
Ethyl 1-[2-[(2-methyl-1,3-thiazol-5-yl)sulfanyl]ethyl]piperidine-4-carboxylate
CID 58328490
Methyl 1-(thiazol-2-yl)piperidine-4-carboxylate
CID 60658785
(1-(Thiazol-2-yl)piperidin-4-yl)methanol
CID 60964790
1-(1,3-Thiazol-2-yl)piperidine-4-carbaldehyde
CID 62663441

Frequently Asked Questions

What is the IUPAC name of ethyl 1-(1,3-thiazol-2-yl)piperidine-4-carboxylate?
The IUPAC name of ethyl 1-(1,3-thiazol-2-yl)piperidine-4-carboxylate (CID 60658779) is ethyl 1-(1,3-thiazol-2-yl)piperidine-4-carboxylate.
What is the SMILES notation for ethyl 1-(1,3-thiazol-2-yl)piperidine-4-carboxylate?
The canonical SMILES for ethyl 1-(1,3-thiazol-2-yl)piperidine-4-carboxylate is CCOC(=O)C1CCN(c2nccs2)CC1.
What is the InChIKey of ethyl 1-(1,3-thiazol-2-yl)piperidine-4-carboxylate?
The InChIKey is ZZCNNRSAQYOGGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2S/c1-2-15-10(14)9-3-6-13(7-4-9)11-12-5-8-16-11/h5,8-9H,2-4,6-7H2,1H3.
What are the key properties of ethyl 1-(1,3-thiazol-2-yl)piperidine-4-carboxylate?
ethyl 1-(1,3-thiazol-2-yl)piperidine-4-carboxylate has a molecular weight of 240.33 g/mol, XLogP of 1.92, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 1-(1,3-thiazol-2-yl)piperidine-4-carboxylate is sourced from PubChem (CID 60658779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).