N,3-dimethyl-N-(1,3-thiazol-4-ylmethyl)piperidine-3-carboxamide

C12H19N3OS — CID 55164319

IUPACN,3-dimethyl-N-(1,3-thiazol-4-ylmethyl)piperidine-3-carboxamide
SMILESCN(Cc1cscn1)C(=O)C1(C)CCCNC1
InChIInChI=1S/C12H19N3OS/c1-12(4-3-5-13-8-12)11(16)15(2)6-10-7-17-9-14-10/h7,9,13H,3-6,8H2,1-2H3
InChIKeyMAJOZWDQVRGACO-UHFFFAOYSA-N
MW253.37 g/mol
LogP1.49
Rot. Bonds3

About N,3-dimethyl-N-(1,3-thiazol-4-ylmethyl)piperidine-3-carboxamide

N,3-dimethyl-N-(1,3-thiazol-4-ylmethyl)piperidine-3-carboxamide (PubChem CID 55164319) has the molecular formula C12H19N3OS and a molecular weight of 253.37 g/mol. Its IUPAC name is N,3-dimethyl-N-(1,3-thiazol-4-ylmethyl)piperidine-3-carboxamide.

Molecular Properties

Compound NameN,3-dimethyl-N-(1,3-thiazol-4-ylmethyl)piperidine-3-carboxamide
PubChem CID55164319
Molecular FormulaC12H19N3OS
Molecular Weight253.37 g/mol
Exact Mass253.12
IUPAC NameN,3-dimethyl-N-(1,3-thiazol-4-ylmethyl)piperidine-3-carboxamide
SMILESCN(Cc1cscn1)C(=O)C1(C)CCCNC1
InChIInChI=1S/C12H19N3OS/c1-12(4-3-5-13-8-12)11(16)15(2)6-10-7-17-9-14-10/h7,9,13H,3-6,8H2,1-2H3
InChIKeyMAJOZWDQVRGACO-UHFFFAOYSA-N
XLogP1.49
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 ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-ethyl-N-methyl-N-(1,3-thiazol-4-ylmethyl)pyrrolidine-2-carboxamide
CID 83071366
N,3-dimethyl-N-[(1-methylpyrazol-4-yl)methyl]piperidine-3-carboxamide;dihydrochloride
CID 119946233
N-[(4-ethylphenyl)methyl]-N,3-dimethylpiperidine-3-carboxamide;hydrochloride
CID 119943770
N,3-dimethyl-N-[(4-propan-2-ylphenyl)methyl]piperidine-3-carboxamide
CID 63131135
N,3-dimethyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]pyrrolidine-3-carboxamide;dihydrochloride
CID 119876575
N-[(2-ethoxyphenyl)methyl]-N,3-dimethylpiperidine-3-carboxamide
CID 63131473
N-methyl-N-(1,3-thiazol-4-ylmethyl)pyrrolidine-1-carboxamide
CID 115592952
1-benzyl-N-methyl-N-(1,3-thiazol-4-ylmethyl)cyclobutane-1-carboxamide
CID 75495083
1-(4-aminophenyl)-N-methyl-N-(1,3-thiazol-4-ylmethyl)cyclopropane-1-carboxamide
CID 115913584
N-(2-hydroxy-2-methylpropyl)-N,3-dimethylpiperidine-3-carboxamide
CID 79377525
methyl 2-[methyl-(3-methylpiperidine-3-carbonyl)amino]acetate
CID 63131941
2-(azetidin-3-yl)-N-methyl-N-(1,3-thiazol-4-ylmethyl)propanamide
CID 116677484

Frequently Asked Questions

What is the IUPAC name of N,3-dimethyl-N-(1,3-thiazol-4-ylmethyl)piperidine-3-carboxamide?
The IUPAC name of N,3-dimethyl-N-(1,3-thiazol-4-ylmethyl)piperidine-3-carboxamide (CID 55164319) is N,3-dimethyl-N-(1,3-thiazol-4-ylmethyl)piperidine-3-carboxamide.
What is the SMILES notation for N,3-dimethyl-N-(1,3-thiazol-4-ylmethyl)piperidine-3-carboxamide?
The canonical SMILES for N,3-dimethyl-N-(1,3-thiazol-4-ylmethyl)piperidine-3-carboxamide is CN(Cc1cscn1)C(=O)C1(C)CCCNC1.
What is the InChIKey of N,3-dimethyl-N-(1,3-thiazol-4-ylmethyl)piperidine-3-carboxamide?
The InChIKey is MAJOZWDQVRGACO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3OS/c1-12(4-3-5-13-8-12)11(16)15(2)6-10-7-17-9-14-10/h7,9,13H,3-6,8H2,1-2H3.
What are the key properties of N,3-dimethyl-N-(1,3-thiazol-4-ylmethyl)piperidine-3-carboxamide?
N,3-dimethyl-N-(1,3-thiazol-4-ylmethyl)piperidine-3-carboxamide has a molecular weight of 253.37 g/mol, XLogP of 1.49, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-dimethyl-N-(1,3-thiazol-4-ylmethyl)piperidine-3-carboxamide is sourced from PubChem (CID 55164319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).