4-methyl-2-(methylamino)-N-(2-methyl-2-piperidin-1-ylpropyl)-1,3-thiazole-5-carboxamide

C15H26N4OS — CID 46981430

IUPAC4-methyl-2-(methylamino)-N-(2-methyl-2-piperidin-1-ylpropyl)-1,3-thiazole-5-carboxamide
SMILESCNc1nc(C)c(C(=O)NCC(C)(C)N2CCCCC2)s1
InChIInChI=1S/C15H26N4OS/c1-11-12(21-14(16-4)18-11)13(20)17-10-15(2,3)19-8-6-5-7-9-19/h5-10H2,1-4H3,(H,16,18)(H,17,20)
InChIKeyAYAPWOOCSVTUJG-UHFFFAOYSA-N
MW310.47 g/mol
LogP2.49
Rot. Bonds5

About 4-methyl-2-(methylamino)-N-(2-methyl-2-piperidin-1-ylpropyl)-1,3-thiazole-5-carboxamide

4-methyl-2-(methylamino)-N-(2-methyl-2-piperidin-1-ylpropyl)-1,3-thiazole-5-carboxamide (PubChem CID 46981430) has the molecular formula C15H26N4OS and a molecular weight of 310.47 g/mol. Its IUPAC name is 4-methyl-2-(methylamino)-N-(2-methyl-2-piperidin-1-ylpropyl)-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name4-methyl-2-(methylamino)-N-(2-methyl-2-piperidin-1-ylpropyl)-1,3-thiazole-5-carboxamide
PubChem CID46981430
Molecular FormulaC15H26N4OS
Molecular Weight310.47 g/mol
Exact Mass310.18
IUPAC Name4-methyl-2-(methylamino)-N-(2-methyl-2-piperidin-1-ylpropyl)-1,3-thiazole-5-carboxamide
SMILESCNc1nc(C)c(C(=O)NCC(C)(C)N2CCCCC2)s1
InChIInChI=1S/C15H26N4OS/c1-11-12(21-14(16-4)18-11)13(20)17-10-15(2,3)19-8-6-5-7-9-19/h5-10H2,1-4H3,(H,16,18)(H,17,20)
InChIKeyAYAPWOOCSVTUJG-UHFFFAOYSA-N
XLogP2.49
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.47
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-(methylamino)-N-(2-methyl-2-piperidin-1-ylpropyl)-1,3-thiazole-5-carboxamide?
The IUPAC name of 4-methyl-2-(methylamino)-N-(2-methyl-2-piperidin-1-ylpropyl)-1,3-thiazole-5-carboxamide (CID 46981430) is 4-methyl-2-(methylamino)-N-(2-methyl-2-piperidin-1-ylpropyl)-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 4-methyl-2-(methylamino)-N-(2-methyl-2-piperidin-1-ylpropyl)-1,3-thiazole-5-carboxamide?
The canonical SMILES for 4-methyl-2-(methylamino)-N-(2-methyl-2-piperidin-1-ylpropyl)-1,3-thiazole-5-carboxamide is CNc1nc(C)c(C(=O)NCC(C)(C)N2CCCCC2)s1.
What is the InChIKey of 4-methyl-2-(methylamino)-N-(2-methyl-2-piperidin-1-ylpropyl)-1,3-thiazole-5-carboxamide?
The InChIKey is AYAPWOOCSVTUJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4OS/c1-11-12(21-14(16-4)18-11)13(20)17-10-15(2,3)19-8-6-5-7-9-19/h5-10H2,1-4H3,(H,16,18)(H,17,20).
What are the key properties of 4-methyl-2-(methylamino)-N-(2-methyl-2-piperidin-1-ylpropyl)-1,3-thiazole-5-carboxamide?
4-methyl-2-(methylamino)-N-(2-methyl-2-piperidin-1-ylpropyl)-1,3-thiazole-5-carboxamide has a molecular weight of 310.47 g/mol, XLogP of 2.49, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-(methylamino)-N-(2-methyl-2-piperidin-1-ylpropyl)-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 46981430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).