N-methyl-1-(1,3-thiazole-5-carbonyl)piperidine-3-carboxamide

C11H15N3O2S — CID 73439408

IUPACN-methyl-1-(1,3-thiazole-5-carbonyl)piperidine-3-carboxamide
SMILESCNC(=O)C1CCCN(C(=O)c2cncs2)C1
InChIInChI=1S/C11H15N3O2S/c1-12-10(15)8-3-2-4-14(6-8)11(16)9-5-13-7-17-9/h5,7-8H,2-4,6H2,1H3,(H,12,15)
InChIKeyKOLZBDOWQSCTTC-UHFFFAOYSA-N
MW253.33 g/mol
LogP0.74
Rot. Bonds2

About N-methyl-1-(1,3-thiazole-5-carbonyl)piperidine-3-carboxamide

N-methyl-1-(1,3-thiazole-5-carbonyl)piperidine-3-carboxamide (PubChem CID 73439408) has the molecular formula C11H15N3O2S and a molecular weight of 253.33 g/mol. Its IUPAC name is N-methyl-1-(1,3-thiazole-5-carbonyl)piperidine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-1-(1,3-thiazole-5-carbonyl)piperidine-3-carboxamide
PubChem CID73439408
Molecular FormulaC11H15N3O2S
Molecular Weight253.33 g/mol
Exact Mass253.09
IUPAC NameN-methyl-1-(1,3-thiazole-5-carbonyl)piperidine-3-carboxamide
SMILESCNC(=O)C1CCCN(C(=O)c2cncs2)C1
InChIInChI=1S/C11H15N3O2S/c1-12-10(15)8-3-2-4-14(6-8)11(16)9-5-13-7-17-9/h5,7-8H,2-4,6H2,1H3,(H,12,15)
InChIKeyKOLZBDOWQSCTTC-UHFFFAOYSA-N
XLogP0.74
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.33
LogP ≤ 50.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[3-[(2-Cyclobutyl-1,3-thiazol-5-yl)methylamino]propyl]piperidin-2-one
CID 75380796
2-(1,3-thiazol-5-ylmethyl)-3,4,4a,5,7,8,9,9a-octahydro-1H-pyrido[3,4-d]azepin-6-one
CID 134789159
2-Ethyl-8-[(2-methyl-1,3-thiazol-5-yl)carbonyl]-2,8-diazaspiro[4.5]decan-3-one
CID 70717540
(3S)-1-acetyl-N-(2-methoxyethyl)-N-(1,3-thiazol-5-ylmethyl)piperidine-3-carboxamide
CID 164629798
N-[[1-[(2S)-2-hydroxypropanoyl]piperidin-4-yl]methyl]-1,3-thiazole-5-carboxamide
CID 164634304
N-((1r,4r)-4-aminocyclohexyl)thiazole-5-carboxamide
CID 108041300
N-(1-(1-(L-alanyl)piperidin-4-yl)ethyl)thiazole-5-carboxamide
CID 132227731
N-((1r,4r)-4-(3-aminopropanamido)cyclohexyl)thiazole-5-carboxamide
CID 132228218
N-(2-aminoethyl)-1-[[2-(trifluoromethyl)-1,3-thiazol-5-yl]methyl]piperidine-3-carboxamide
CID 120837338
N-[[1-(3-fluorocyclopentanecarbonyl)azepan-4-yl]methyl]-1,3-thiazole-5-carboxamide
CID 154856127
N-[(2S,4R)-2-(trifluoromethyl)piperidin-4-yl]-1,3-thiazole-5-carboxamide
CID 166323901
(2-Bromothiazol-5-yl)(3-(trifluoromethyl)piperidin-1-yl)methanone
CID 167312022

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(1,3-thiazole-5-carbonyl)piperidine-3-carboxamide?
The IUPAC name of N-methyl-1-(1,3-thiazole-5-carbonyl)piperidine-3-carboxamide (CID 73439408) is N-methyl-1-(1,3-thiazole-5-carbonyl)piperidine-3-carboxamide.
What is the SMILES notation for N-methyl-1-(1,3-thiazole-5-carbonyl)piperidine-3-carboxamide?
The canonical SMILES for N-methyl-1-(1,3-thiazole-5-carbonyl)piperidine-3-carboxamide is CNC(=O)C1CCCN(C(=O)c2cncs2)C1.
What is the InChIKey of N-methyl-1-(1,3-thiazole-5-carbonyl)piperidine-3-carboxamide?
The InChIKey is KOLZBDOWQSCTTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O2S/c1-12-10(15)8-3-2-4-14(6-8)11(16)9-5-13-7-17-9/h5,7-8H,2-4,6H2,1H3,(H,12,15).
What are the key properties of N-methyl-1-(1,3-thiazole-5-carbonyl)piperidine-3-carboxamide?
N-methyl-1-(1,3-thiazole-5-carbonyl)piperidine-3-carboxamide has a molecular weight of 253.33 g/mol, XLogP of 0.74, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(1,3-thiazole-5-carbonyl)piperidine-3-carboxamide is sourced from PubChem (CID 73439408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).