N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methylpiperidine-4-carboxamide

C13H19N3OS — CID 114278849

IUPACN-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methylpiperidine-4-carboxamide
SMILESCC1CNCCC1C(=O)Nc1nc(C2CC2)cs1
InChIInChI=1S/C13H19N3OS/c1-8-6-14-5-4-10(8)12(17)16-13-15-11(7-18-13)9-2-3-9/h7-10,14H,2-6H2,1H3,(H,15,16,17)
InChIKeyBEISVHYUEUZFBS-UHFFFAOYSA-N
MW265.38 g/mol
LogP2.20
Rot. Bonds3

About N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methylpiperidine-4-carboxamide

N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methylpiperidine-4-carboxamide (PubChem CID 114278849) has the molecular formula C13H19N3OS and a molecular weight of 265.38 g/mol. Its IUPAC name is N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methylpiperidine-4-carboxamide
PubChem CID114278849
Molecular FormulaC13H19N3OS
Molecular Weight265.38 g/mol
Exact Mass265.12
IUPAC NameN-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methylpiperidine-4-carboxamide
SMILESCC1CNCCC1C(=O)Nc1nc(C2CC2)cs1
InChIInChI=1S/C13H19N3OS/c1-8-6-14-5-4-10(8)12(17)16-13-15-11(7-18-13)9-2-3-9/h7-10,14H,2-6H2,1H3,(H,15,16,17)
InChIKeyBEISVHYUEUZFBS-UHFFFAOYSA-N
XLogP2.20
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.38
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-cyclopropyl-1,3-thiazol-2-yl)-4-methylpiperidine-2-carboxamide
CID 114423810
(2R)-N-(4-cyclopropyl-1,3-thiazol-2-yl)pyrrolidine-2-carboxamide
CID 103795480
N-(4-cyclopropyl-1,3-thiazol-2-yl)-4-ethylpiperidine-4-carboxamide
CID 63129094
(1S)-2,2-dichloro-N-(4-cyclopropyl-1,3-thiazol-2-yl)cyclopropane-1-carboxamide
CID 33302453
1-N,4-N-bis(4-cyclopropyl-1,3-thiazol-2-yl)benzene-1,4-dicarboxamide
CID 32869371
2-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)-2-methylpropanamide;hydrochloride
CID 119292978
N-(4-cyclopropyl-1,3-thiazol-2-yl)-1,3-thiazolidine-4-carboxamide
CID 61482512
2-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)-2-methylbutanamide
CID 79805640
N-(4-cyclopropyl-1,3-thiazol-2-yl)-4-methylpiperidine-1-carboxamide
CID 47200504
(3S)-N-(4-cyclopropyl-1,3-thiazol-2-yl)oxolane-3-carboxamide
CID 94211482
N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methylpiperidine-1-carboxamide
CID 47200519
N-(4-cyclopropyl-1,3-thiazol-2-yl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
CID 120623224

Frequently Asked Questions

What is the IUPAC name of N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methylpiperidine-4-carboxamide?
The IUPAC name of N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methylpiperidine-4-carboxamide (CID 114278849) is N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methylpiperidine-4-carboxamide.
What is the SMILES notation for N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methylpiperidine-4-carboxamide?
The canonical SMILES for N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methylpiperidine-4-carboxamide is CC1CNCCC1C(=O)Nc1nc(C2CC2)cs1.
What is the InChIKey of N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methylpiperidine-4-carboxamide?
The InChIKey is BEISVHYUEUZFBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3OS/c1-8-6-14-5-4-10(8)12(17)16-13-15-11(7-18-13)9-2-3-9/h7-10,14H,2-6H2,1H3,(H,15,16,17).
What are the key properties of N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methylpiperidine-4-carboxamide?
N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methylpiperidine-4-carboxamide has a molecular weight of 265.38 g/mol, XLogP of 2.20, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methylpiperidine-4-carboxamide is sourced from PubChem (CID 114278849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).