2-methyl-N-(5-methyl-1,3-thiazol-2-yl)piperidine-4-carboxamide

C11H17N3OS — CID 106738614

IUPAC2-methyl-N-(5-methyl-1,3-thiazol-2-yl)piperidine-4-carboxamide
SMILESCc1cnc(NC(=O)C2CCNC(C)C2)s1
InChIInChI=1S/C11H17N3OS/c1-7-5-9(3-4-12-7)10(15)14-11-13-6-8(2)16-11/h6-7,9,12H,3-5H2,1-2H3,(H,13,14,15)
InChIKeyPIPWIGJBMXZZLL-UHFFFAOYSA-N
MW239.34 g/mol
LogP1.78
Rot. Bonds2

About 2-methyl-N-(5-methyl-1,3-thiazol-2-yl)piperidine-4-carboxamide

2-methyl-N-(5-methyl-1,3-thiazol-2-yl)piperidine-4-carboxamide (PubChem CID 106738614) has the molecular formula C11H17N3OS and a molecular weight of 239.34 g/mol. Its IUPAC name is 2-methyl-N-(5-methyl-1,3-thiazol-2-yl)piperidine-4-carboxamide.

Molecular Properties

Compound Name2-methyl-N-(5-methyl-1,3-thiazol-2-yl)piperidine-4-carboxamide
PubChem CID106738614
Molecular FormulaC11H17N3OS
Molecular Weight239.34 g/mol
Exact Mass239.11
IUPAC Name2-methyl-N-(5-methyl-1,3-thiazol-2-yl)piperidine-4-carboxamide
SMILESCc1cnc(NC(=O)C2CCNC(C)C2)s1
InChIInChI=1S/C11H17N3OS/c1-7-5-9(3-4-12-7)10(15)14-11-13-6-8(2)16-11/h6-7,9,12H,3-5H2,1-2H3,(H,13,14,15)
InChIKeyPIPWIGJBMXZZLL-UHFFFAOYSA-N
XLogP1.78
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.34
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-methyl-1,3-thiazol-2-yl)cyclopropanecarboxamide
CID 3432578
(2S,4S)-2-methyl-N-[2-(5-methyl-1,3-thiazol-2-yl)propan-2-yl]piperidine-4-carboxamide
CID 120645775
(2S,4S)-2-methyl-N-[5-[(4-methylphenyl)methyl]-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide
CID 120631372
(2S,4S)-N-[5-(difluoromethyl)-1,3,4-thiadiazol-2-yl]-2-methylpiperidine-4-carboxamide
CID 120625071
(2S,4S)-N-(3,5-difluorophenyl)-2-methylpiperidine-4-carboxamide
CID 120619158
(2S,4S)-N-[5-(methanesulfonamido)-1,3,4-thiadiazol-2-yl]-2-methylpiperidine-4-carboxamide
CID 120624142
2-[(5-methyl-1,3-thiazol-2-yl)carbamoyl]cyclohexane-1-carboxylic acid
CID 2969362
N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-2-methylpiperidine-4-carboxamide
CID 106739831
(2S,4S)-2-methyl-N-(3-methyl-2-pyridinyl)piperidine-4-carboxamide;hydrochloride
CID 120631492
(2S,4S)-N-[4-(cyclopropanecarbonylamino)phenyl]-2-methylpiperidine-4-carboxamide;hydrochloride
CID 120619530
N-(5-methyl-1,3-thiazol-2-yl)-1-sulfamoylpiperidine-4-carboxamide
CID 47158637
2-[[(2S,4S)-2-methylpiperidine-4-carbonyl]amino]-1,3-thiazole-4-carboxamide;hydrochloride
CID 120634432

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(5-methyl-1,3-thiazol-2-yl)piperidine-4-carboxamide?
The IUPAC name of 2-methyl-N-(5-methyl-1,3-thiazol-2-yl)piperidine-4-carboxamide (CID 106738614) is 2-methyl-N-(5-methyl-1,3-thiazol-2-yl)piperidine-4-carboxamide.
What is the SMILES notation for 2-methyl-N-(5-methyl-1,3-thiazol-2-yl)piperidine-4-carboxamide?
The canonical SMILES for 2-methyl-N-(5-methyl-1,3-thiazol-2-yl)piperidine-4-carboxamide is Cc1cnc(NC(=O)C2CCNC(C)C2)s1.
What is the InChIKey of 2-methyl-N-(5-methyl-1,3-thiazol-2-yl)piperidine-4-carboxamide?
The InChIKey is PIPWIGJBMXZZLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3OS/c1-7-5-9(3-4-12-7)10(15)14-11-13-6-8(2)16-11/h6-7,9,12H,3-5H2,1-2H3,(H,13,14,15).
What are the key properties of 2-methyl-N-(5-methyl-1,3-thiazol-2-yl)piperidine-4-carboxamide?
2-methyl-N-(5-methyl-1,3-thiazol-2-yl)piperidine-4-carboxamide has a molecular weight of 239.34 g/mol, XLogP of 1.78, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(5-methyl-1,3-thiazol-2-yl)piperidine-4-carboxamide is sourced from PubChem (CID 106738614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).