2-[2-[2-methoxyethyl(methyl)amino]ethoxy]-N-(4-methyl-1,3-thiazol-2-yl)-6-propan-2-yloxypyridine-4-carboxamide

C19H28N4O4S — CID 143828211

IUPAC2-[2-[2-methoxyethyl(methyl)amino]ethoxy]-N-(4-methyl-1,3-thiazol-2-yl)-6-propan-2-yloxypyridine-4-carboxamide
SMILESCOCCN(C)CCOc1cc(C(=O)Nc2nc(C)cs2)cc(OC(C)C)n1
InChIInChI=1S/C19H28N4O4S/c1-13(2)27-17-11-15(18(24)22-19-20-14(3)12-28-19)10-16(21-17)26-9-7-23(4)6-8-25-5/h10-13H,6-9H2,1-5H3,(H,20,22,24)
InChIKeyXYDOMPRRADWQQG-UHFFFAOYSA-N
MW408.52 g/mol
LogP2.84
Rot. Bonds11

About 2-[2-[2-methoxyethyl(methyl)amino]ethoxy]-N-(4-methyl-1,3-thiazol-2-yl)-6-propan-2-yloxypyridine-4-carboxamide

2-[2-[2-methoxyethyl(methyl)amino]ethoxy]-N-(4-methyl-1,3-thiazol-2-yl)-6-propan-2-yloxypyridine-4-carboxamide (PubChem CID 143828211) has the molecular formula C19H28N4O4S and a molecular weight of 408.52 g/mol. Its IUPAC name is 2-[2-[2-methoxyethyl(methyl)amino]ethoxy]-N-(4-methyl-1,3-thiazol-2-yl)-6-propan-2-yloxypyridine-4-carboxamide.

Molecular Properties

Compound Name2-[2-[2-methoxyethyl(methyl)amino]ethoxy]-N-(4-methyl-1,3-thiazol-2-yl)-6-propan-2-yloxypyridine-4-carboxamide
PubChem CID143828211
Molecular FormulaC19H28N4O4S
Molecular Weight408.52 g/mol
Exact Mass408.18
IUPAC Name2-[2-[2-methoxyethyl(methyl)amino]ethoxy]-N-(4-methyl-1,3-thiazol-2-yl)-6-propan-2-yloxypyridine-4-carboxamide
SMILESCOCCN(C)CCOc1cc(C(=O)Nc2nc(C)cs2)cc(OC(C)C)n1
InChIInChI=1S/C19H28N4O4S/c1-13(2)27-17-11-15(18(24)22-19-20-14(3)12-28-19)10-16(21-17)26-9-7-23(4)6-8-25-5/h10-13H,6-9H2,1-5H3,(H,20,22,24)
InChIKeyXYDOMPRRADWQQG-UHFFFAOYSA-N
XLogP2.84
TPSA85.81 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds11
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.52
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

2-[(2S)-1-methoxypropan-2-yl]oxy-N-(4-methyl-1,3-thiazol-2-yl)-6-propan-2-yloxypyridine-4-carboxamide
CID 143828242
2-(1-methoxypropan-2-yloxy)-N-(4-methyl-1,3-thiazol-2-yl)-6-(1-phenylpropan-2-yloxy)pyridine-4-carboxamide
CID 87420038
2-(4-fluorophenoxy)-N-(4-methyl-1,3-thiazol-2-yl)-6-propan-2-yloxypyridine-4-carboxamide
CID 87419945
3-methoxy-N-(4-methyl-1,3-thiazol-2-yl)-4-propan-2-yloxybenzamide
CID 46674292
5-chloro-N-(4-methyl-1,3-thiazol-2-yl)-6-propan-2-yloxypyridine-3-carboxamide
CID 47293511
3-methoxy-4-methyl-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 17425685
3,5-dimethyl-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 1246749
2-chloro-6-(1-methoxypropan-2-yloxy)-N-(4-methyl-1,3-thiazol-2-yl)pyrimidine-4-carboxamide
CID 71496472
ethyl 2-[2-[[2-(1,3-difluoropropan-2-yloxy)-6-propan-2-yloxypyridine-4-carbonyl]amino]-1,3-thiazol-4-yl]acetate
CID 87420005
2-[2-[[2-(1-phenylpropan-2-yloxy)-6-propan-2-yloxypyridine-4-carbonyl]amino]-1,3-thiazol-4-yl]acetic acid
CID 87419918
2-benzamido-N,N-bis(2-methoxyethyl)-1,3-thiazole-4-carboxamide
CID 16914887
3-(2-methylpropoxy)-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 30854706

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-methoxyethyl(methyl)amino]ethoxy]-N-(4-methyl-1,3-thiazol-2-yl)-6-propan-2-yloxypyridine-4-carboxamide?
The IUPAC name of 2-[2-[2-methoxyethyl(methyl)amino]ethoxy]-N-(4-methyl-1,3-thiazol-2-yl)-6-propan-2-yloxypyridine-4-carboxamide (CID 143828211) is 2-[2-[2-methoxyethyl(methyl)amino]ethoxy]-N-(4-methyl-1,3-thiazol-2-yl)-6-propan-2-yloxypyridine-4-carboxamide.
What is the SMILES notation for 2-[2-[2-methoxyethyl(methyl)amino]ethoxy]-N-(4-methyl-1,3-thiazol-2-yl)-6-propan-2-yloxypyridine-4-carboxamide?
The canonical SMILES for 2-[2-[2-methoxyethyl(methyl)amino]ethoxy]-N-(4-methyl-1,3-thiazol-2-yl)-6-propan-2-yloxypyridine-4-carboxamide is COCCN(C)CCOc1cc(C(=O)Nc2nc(C)cs2)cc(OC(C)C)n1.
What is the InChIKey of 2-[2-[2-methoxyethyl(methyl)amino]ethoxy]-N-(4-methyl-1,3-thiazol-2-yl)-6-propan-2-yloxypyridine-4-carboxamide?
The InChIKey is XYDOMPRRADWQQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N4O4S/c1-13(2)27-17-11-15(18(24)22-19-20-14(3)12-28-19)10-16(21-17)26-9-7-23(4)6-8-25-5/h10-13H,6-9H2,1-5H3,(H,20,22,24).
What are the key properties of 2-[2-[2-methoxyethyl(methyl)amino]ethoxy]-N-(4-methyl-1,3-thiazol-2-yl)-6-propan-2-yloxypyridine-4-carboxamide?
2-[2-[2-methoxyethyl(methyl)amino]ethoxy]-N-(4-methyl-1,3-thiazol-2-yl)-6-propan-2-yloxypyridine-4-carboxamide has a molecular weight of 408.52 g/mol, XLogP of 2.84, 11 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-methoxyethyl(methyl)amino]ethoxy]-N-(4-methyl-1,3-thiazol-2-yl)-6-propan-2-yloxypyridine-4-carboxamide is sourced from PubChem (CID 143828211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).