6-methyl-N-(4-methyl-1,3-thiazol-2-yl)-4-(oxan-3-yloxy)pyridine-2-carboxamide

C16H19N3O3S — CID 118612952

IUPAC6-methyl-N-(4-methyl-1,3-thiazol-2-yl)-4-(oxan-3-yloxy)pyridine-2-carboxamide
SMILESCc1cc(OC2CCCOC2)cc(C(=O)Nc2nc(C)cs2)n1
InChIInChI=1S/C16H19N3O3S/c1-10-6-13(22-12-4-3-5-21-8-12)7-14(17-10)15(20)19-16-18-11(2)9-23-16/h6-7,9,12H,3-5,8H2,1-2H3,(H,18,19,20)
InChIKeyCXNLRHCUZZBCDP-UHFFFAOYSA-N
MW333.41 g/mol
LogP2.97
Rot. Bonds4

About 6-methyl-N-(4-methyl-1,3-thiazol-2-yl)-4-(oxan-3-yloxy)pyridine-2-carboxamide

6-methyl-N-(4-methyl-1,3-thiazol-2-yl)-4-(oxan-3-yloxy)pyridine-2-carboxamide (PubChem CID 118612952) has the molecular formula C16H19N3O3S and a molecular weight of 333.41 g/mol. Its IUPAC name is 6-methyl-N-(4-methyl-1,3-thiazol-2-yl)-4-(oxan-3-yloxy)pyridine-2-carboxamide.

Molecular Properties

Compound Name6-methyl-N-(4-methyl-1,3-thiazol-2-yl)-4-(oxan-3-yloxy)pyridine-2-carboxamide
PubChem CID118612952
Molecular FormulaC16H19N3O3S
Molecular Weight333.41 g/mol
Exact Mass333.11
IUPAC Name6-methyl-N-(4-methyl-1,3-thiazol-2-yl)-4-(oxan-3-yloxy)pyridine-2-carboxamide
SMILESCc1cc(OC2CCCOC2)cc(C(=O)Nc2nc(C)cs2)n1
InChIInChI=1S/C16H19N3O3S/c1-10-6-13(22-12-4-3-5-21-8-12)7-14(17-10)15(20)19-16-18-11(2)9-23-16/h6-7,9,12H,3-5,8H2,1-2H3,(H,18,19,20)
InChIKeyCXNLRHCUZZBCDP-UHFFFAOYSA-N
XLogP2.97
TPSA73.34 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.41
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

CID 118609053
CID 118609053
CID 118612925
CID 118612925
CID 118612937
CID 118612937
CID 118612938
CID 118612938
CID 118612955
CID 118612955
CID 118612958
CID 118612958
CID 118612971
CID 118612971
CID 118612974
CID 118612974
CID 118612993
CID 118612993
CID 118613025
CID 118613025
CID 118613049
CID 118613049
CID 118613066
CID 118613066

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-(4-methyl-1,3-thiazol-2-yl)-4-(oxan-3-yloxy)pyridine-2-carboxamide?
The IUPAC name of 6-methyl-N-(4-methyl-1,3-thiazol-2-yl)-4-(oxan-3-yloxy)pyridine-2-carboxamide (CID 118612952) is 6-methyl-N-(4-methyl-1,3-thiazol-2-yl)-4-(oxan-3-yloxy)pyridine-2-carboxamide.
What is the SMILES notation for 6-methyl-N-(4-methyl-1,3-thiazol-2-yl)-4-(oxan-3-yloxy)pyridine-2-carboxamide?
The canonical SMILES for 6-methyl-N-(4-methyl-1,3-thiazol-2-yl)-4-(oxan-3-yloxy)pyridine-2-carboxamide is Cc1cc(OC2CCCOC2)cc(C(=O)Nc2nc(C)cs2)n1.
What is the InChIKey of 6-methyl-N-(4-methyl-1,3-thiazol-2-yl)-4-(oxan-3-yloxy)pyridine-2-carboxamide?
The InChIKey is CXNLRHCUZZBCDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O3S/c1-10-6-13(22-12-4-3-5-21-8-12)7-14(17-10)15(20)19-16-18-11(2)9-23-16/h6-7,9,12H,3-5,8H2,1-2H3,(H,18,19,20).
What are the key properties of 6-methyl-N-(4-methyl-1,3-thiazol-2-yl)-4-(oxan-3-yloxy)pyridine-2-carboxamide?
6-methyl-N-(4-methyl-1,3-thiazol-2-yl)-4-(oxan-3-yloxy)pyridine-2-carboxamide has a molecular weight of 333.41 g/mol, XLogP of 2.97, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-(4-methyl-1,3-thiazol-2-yl)-4-(oxan-3-yloxy)pyridine-2-carboxamide is sourced from PubChem (CID 118612952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).