N,N-dimethyl-2-(1-pyrimidin-2-ylpiperidin-2-yl)-1,3-thiazole-5-carboxamide

C15H19N5OS — CID 110095106

IUPACN,N-dimethyl-2-(1-pyrimidin-2-ylpiperidin-2-yl)-1,3-thiazole-5-carboxamide
SMILESCN(C)C(=O)c1cnc(C2CCCCN2c2ncccn2)s1
InChIInChI=1S/C15H19N5OS/c1-19(2)14(21)12-10-18-13(22-12)11-6-3-4-9-20(11)15-16-7-5-8-17-15/h5,7-8,10-11H,3-4,6,9H2,1-2H3
InChIKeyRCGILNZLVOOBAW-UHFFFAOYSA-N
MW317.42 g/mol
LogP2.37
Rot. Bonds3

About N,N-dimethyl-2-(1-pyrimidin-2-ylpiperidin-2-yl)-1,3-thiazole-5-carboxamide

N,N-dimethyl-2-(1-pyrimidin-2-ylpiperidin-2-yl)-1,3-thiazole-5-carboxamide (PubChem CID 110095106) has the molecular formula C15H19N5OS and a molecular weight of 317.42 g/mol. Its IUPAC name is N,N-dimethyl-2-(1-pyrimidin-2-ylpiperidin-2-yl)-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-2-(1-pyrimidin-2-ylpiperidin-2-yl)-1,3-thiazole-5-carboxamide
PubChem CID110095106
Molecular FormulaC15H19N5OS
Molecular Weight317.42 g/mol
Exact Mass317.13
IUPAC NameN,N-dimethyl-2-(1-pyrimidin-2-ylpiperidin-2-yl)-1,3-thiazole-5-carboxamide
SMILESCN(C)C(=O)c1cnc(C2CCCCN2c2ncccn2)s1
InChIInChI=1S/C15H19N5OS/c1-19(2)14(21)12-10-18-13(22-12)11-6-3-4-9-20(11)15-16-7-5-8-17-15/h5,7-8,10-11H,3-4,6,9H2,1-2H3
InChIKeyRCGILNZLVOOBAW-UHFFFAOYSA-N
XLogP2.37
TPSA62.22 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.42
LogP ≤ 52.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

2-[(2R)-1-pyrimidin-2-ylpyrrolidin-2-yl]-1,3-thiazole-5-carboxamide
CID 125009220
N,N-dimethyl-2-[(2R)-1-(pyridine-2-carbonyl)pyrrolidin-2-yl]-1,3-thiazole-5-carboxamide
CID 124952535
N-methyl-2-(1-pyridin-2-ylpiperidin-2-yl)-1,3-thiazole-5-carboxamide
CID 110095103
2-[(2S)-1-(2-methylpyrimidin-4-yl)pyrrolidin-2-yl]-1,3-thiazole-5-carboxamide
CID 124940784
2-[(2R)-1-(2-methylpropyl)piperidin-2-yl]-1,3-thiazole-5-carboxamide
CID 125024082
N,N-di(cyclobutyl)-2-pyrimidin-2-yl-1,3-thiazole-5-carboxamide
CID 128533423
N,1-dimethyl-5-[(2S)-1-pyrimidin-2-ylpiperidin-2-yl]pyrrole-2-carboxamide
CID 129329726
2-[(2R)-1-benzoylpiperidin-2-yl]-N-methyl-1,3-thiazole-5-carboxamide
CID 124972626
2-[(2R)-1-(2,2-dimethylpropanoyl)piperidin-2-yl]-N-methyl-1,3-thiazole-5-carboxamide
CID 125008264
(4-hydroxy-4-methylpiperidin-1-yl)-(1-pyrimidin-2-ylpyrrolidin-2-yl)methanone
CID 80702244
2-[2-(4-fluorophenyl)piperidin-1-yl]pyrimidine
CID 154749859
2-[1-[(2-fluorophenyl)methyl]piperidin-2-yl]-1,3-thiazole-5-carboxamide
CID 110109904

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-(1-pyrimidin-2-ylpiperidin-2-yl)-1,3-thiazole-5-carboxamide?
The IUPAC name of N,N-dimethyl-2-(1-pyrimidin-2-ylpiperidin-2-yl)-1,3-thiazole-5-carboxamide (CID 110095106) is N,N-dimethyl-2-(1-pyrimidin-2-ylpiperidin-2-yl)-1,3-thiazole-5-carboxamide.
What is the SMILES notation for N,N-dimethyl-2-(1-pyrimidin-2-ylpiperidin-2-yl)-1,3-thiazole-5-carboxamide?
The canonical SMILES for N,N-dimethyl-2-(1-pyrimidin-2-ylpiperidin-2-yl)-1,3-thiazole-5-carboxamide is CN(C)C(=O)c1cnc(C2CCCCN2c2ncccn2)s1.
What is the InChIKey of N,N-dimethyl-2-(1-pyrimidin-2-ylpiperidin-2-yl)-1,3-thiazole-5-carboxamide?
The InChIKey is RCGILNZLVOOBAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5OS/c1-19(2)14(21)12-10-18-13(22-12)11-6-3-4-9-20(11)15-16-7-5-8-17-15/h5,7-8,10-11H,3-4,6,9H2,1-2H3.
What are the key properties of N,N-dimethyl-2-(1-pyrimidin-2-ylpiperidin-2-yl)-1,3-thiazole-5-carboxamide?
N,N-dimethyl-2-(1-pyrimidin-2-ylpiperidin-2-yl)-1,3-thiazole-5-carboxamide has a molecular weight of 317.42 g/mol, XLogP of 2.37, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-(1-pyrimidin-2-ylpiperidin-2-yl)-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 110095106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).