2-methyl-N-(2-methylpiperidin-4-yl)-1,3-thiazole-5-carboxamide

C11H17N3OS — CID 107093535

IUPAC2-methyl-N-(2-methylpiperidin-4-yl)-1,3-thiazole-5-carboxamide
SMILESCc1ncc(C(=O)NC2CCNC(C)C2)s1
InChIInChI=1S/C11H17N3OS/c1-7-5-9(3-4-12-7)14-11(15)10-6-13-8(2)16-10/h6-7,9,12H,3-5H2,1-2H3,(H,14,15)
InChIKeyICDKRRYSYHOIAO-UHFFFAOYSA-N
MW239.34 g/mol
LogP1.32
Rot. Bonds2

About 2-methyl-N-(2-methylpiperidin-4-yl)-1,3-thiazole-5-carboxamide

2-methyl-N-(2-methylpiperidin-4-yl)-1,3-thiazole-5-carboxamide (PubChem CID 107093535) has the molecular formula C11H17N3OS and a molecular weight of 239.34 g/mol. Its IUPAC name is 2-methyl-N-(2-methylpiperidin-4-yl)-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name2-methyl-N-(2-methylpiperidin-4-yl)-1,3-thiazole-5-carboxamide
PubChem CID107093535
Molecular FormulaC11H17N3OS
Molecular Weight239.34 g/mol
Exact Mass239.11
IUPAC Name2-methyl-N-(2-methylpiperidin-4-yl)-1,3-thiazole-5-carboxamide
SMILESCc1ncc(C(=O)NC2CCNC(C)C2)s1
InChIInChI=1S/C11H17N3OS/c1-7-5-9(3-4-12-7)14-11(15)10-6-13-8(2)16-10/h6-7,9,12H,3-5H2,1-2H3,(H,14,15)
InChIKeyICDKRRYSYHOIAO-UHFFFAOYSA-N
XLogP1.32
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 ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(8-azabicyclo[3.2.1]octan-3-yl)-2-methyl-1,3-thiazole-5-carboxamide;hydrochloride
CID 119459538
2-(dimethylamino)-N-(2-methylpiperidin-4-yl)thieno[2,3-d][1,3]thiazole-5-carboxamide
CID 120599713
2-methyl-N-(6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-yl)-1,3-thiazole-5-carboxamide
CID 91516996
N-(2-methylpiperidin-4-yl)-1-benzothiophene-2-carboxamide
CID 106995225
N-(2-methylpiperidin-4-yl)-2H-triazole-4-carboxamide
CID 106995382
3-methyl-N-(2-methylpiperidin-4-yl)pyridine-2-carboxamide
CID 106995373
N-(2-methylpiperidin-4-yl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide;hydrochloride
CID 120600778
[(2R,4R)-2-methylpiperidin-4-yl]carbamic acid
CID 146485805
3-methoxy-4-methyl-N-(2-methylpiperidin-4-yl)benzamide
CID 106995084
5-(4-chlorophenyl)-N-(2-methylpiperidin-4-yl)thiophene-2-carboxamide
CID 120598957
2-methyl-N-(1-piperidin-3-ylethyl)-1,3-thiazole-5-carboxamide
CID 113265500
1-tert-butyl-5-methyl-N-(2-methylpiperidin-4-yl)pyrazole-4-carboxamide
CID 120602508

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(2-methylpiperidin-4-yl)-1,3-thiazole-5-carboxamide?
The IUPAC name of 2-methyl-N-(2-methylpiperidin-4-yl)-1,3-thiazole-5-carboxamide (CID 107093535) is 2-methyl-N-(2-methylpiperidin-4-yl)-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 2-methyl-N-(2-methylpiperidin-4-yl)-1,3-thiazole-5-carboxamide?
The canonical SMILES for 2-methyl-N-(2-methylpiperidin-4-yl)-1,3-thiazole-5-carboxamide is Cc1ncc(C(=O)NC2CCNC(C)C2)s1.
What is the InChIKey of 2-methyl-N-(2-methylpiperidin-4-yl)-1,3-thiazole-5-carboxamide?
The InChIKey is ICDKRRYSYHOIAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3OS/c1-7-5-9(3-4-12-7)14-11(15)10-6-13-8(2)16-10/h6-7,9,12H,3-5H2,1-2H3,(H,14,15).
What are the key properties of 2-methyl-N-(2-methylpiperidin-4-yl)-1,3-thiazole-5-carboxamide?
2-methyl-N-(2-methylpiperidin-4-yl)-1,3-thiazole-5-carboxamide has a molecular weight of 239.34 g/mol, XLogP of 1.32, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(2-methylpiperidin-4-yl)-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 107093535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).