N-(3-tert-butyl-1,2-thiazol-5-yl)piperidine-2-carboxamide

C13H21N3OS — CID 70865082

IUPACN-(3-tert-butyl-1,2-thiazol-5-yl)piperidine-2-carboxamide
SMILESCC(C)(C)c1cc(NC(=O)C2CCCCN2)sn1
InChIInChI=1S/C13H21N3OS/c1-13(2,3)10-8-11(18-16-10)15-12(17)9-6-4-5-7-14-9/h8-9,14H,4-7H2,1-3H3,(H,15,17)
InChIKeyCGODKGANMBYLIE-UHFFFAOYSA-N
MW267.40 g/mol
LogP2.52
Rot. Bonds2

About N-(3-tert-butyl-1,2-thiazol-5-yl)piperidine-2-carboxamide

N-(3-tert-butyl-1,2-thiazol-5-yl)piperidine-2-carboxamide (PubChem CID 70865082) has the molecular formula C13H21N3OS and a molecular weight of 267.40 g/mol. Its IUPAC name is N-(3-tert-butyl-1,2-thiazol-5-yl)piperidine-2-carboxamide.

Molecular Properties

Compound NameN-(3-tert-butyl-1,2-thiazol-5-yl)piperidine-2-carboxamide
PubChem CID70865082
Molecular FormulaC13H21N3OS
Molecular Weight267.40 g/mol
Exact Mass267.14
IUPAC NameN-(3-tert-butyl-1,2-thiazol-5-yl)piperidine-2-carboxamide
SMILESCC(C)(C)c1cc(NC(=O)C2CCCCN2)sn1
InChIInChI=1S/C13H21N3OS/c1-13(2,3)10-8-11(18-16-10)15-12(17)9-6-4-5-7-14-9/h8-9,14H,4-7H2,1-3H3,(H,15,17)
InChIKeyCGODKGANMBYLIE-UHFFFAOYSA-N
XLogP2.52
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.40
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(3-tert-butyl-1,2-thiazol-5-yl)piperidine-2-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

(2R)-N-(thiadiazol-5-yl)piperidine-2-carboxamide
CID 104982945
tert-butyl (2S)-2-[(3-tert-butyl-1,2-thiazol-5-yl)carbamoyl]piperidine-1-carboxylate
CID 58563765
(2R)-N-(2-tert-butylphenyl)piperidine-2-carboxamide;hydrochloride
CID 119399894
(2R)-N-pyridin-4-ylpiperidine-2-carboxamide;dihydrochloride
CID 119827101
(2R)-N-(4-methylphenyl)piperidine-2-carboxamide;hydrochloride
CID 119670939
N-(5-methyl-1,3,4-thiadiazol-2-yl)piperidine-2-carboxamide;hydrochloride
CID 119265892
N-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)piperidine-2-carboxamide
CID 70865086
(2S)-N-(6-methyl-1,3-benzothiazol-2-yl)piperidine-2-carboxamide;hydrochloride
CID 119674535
N-(6-methyl-1,3-benzothiazol-2-yl)piperidine-2-carboxamide;hydrochloride
CID 119263420
N-pyridin-4-ylazocane-2-carboxamide
CID 114240041
N-(5-methyl-1,2-oxazol-3-yl)piperidine-2-carboxamide
CID 18071476
N-(3,4-dichlorophenyl)piperidine-2-carboxamide;hydrochloride
CID 42943662

Frequently Asked Questions

What is the IUPAC name of N-(3-tert-butyl-1,2-thiazol-5-yl)piperidine-2-carboxamide?
The IUPAC name of N-(3-tert-butyl-1,2-thiazol-5-yl)piperidine-2-carboxamide (CID 70865082) is N-(3-tert-butyl-1,2-thiazol-5-yl)piperidine-2-carboxamide.
What is the SMILES notation for N-(3-tert-butyl-1,2-thiazol-5-yl)piperidine-2-carboxamide?
The canonical SMILES for N-(3-tert-butyl-1,2-thiazol-5-yl)piperidine-2-carboxamide is CC(C)(C)c1cc(NC(=O)C2CCCCN2)sn1.
What is the InChIKey of N-(3-tert-butyl-1,2-thiazol-5-yl)piperidine-2-carboxamide?
The InChIKey is CGODKGANMBYLIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3OS/c1-13(2,3)10-8-11(18-16-10)15-12(17)9-6-4-5-7-14-9/h8-9,14H,4-7H2,1-3H3,(H,15,17).
What are the key properties of N-(3-tert-butyl-1,2-thiazol-5-yl)piperidine-2-carboxamide?
N-(3-tert-butyl-1,2-thiazol-5-yl)piperidine-2-carboxamide has a molecular weight of 267.40 g/mol, XLogP of 2.52, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-tert-butyl-1,2-thiazol-5-yl)piperidine-2-carboxamide is sourced from PubChem (CID 70865082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).