3-[4-(2-methyl-3-pyridinyl)-1,3-thiazol-2-yl]-5-morpholin-4-ylpyridine-2-carboxamide

C19H19N5O2S — CID 175867067

IUPAC3-[4-(2-methyl-3-pyridinyl)-1,3-thiazol-2-yl]-5-morpholin-4-ylpyridine-2-carboxamide
SMILESCc1ncccc1-c1csc(-c2cc(N3CCOCC3)cnc2C(N)=O)n1
InChIInChI=1S/C19H19N5O2S/c1-12-14(3-2-4-21-12)16-11-27-19(23-16)15-9-13(10-22-17(15)18(20)25)24-5-7-26-8-6-24/h2-4,9-11H,5-8H2,1H3,(H2,20,25)
InChIKeyCLYJMYBEVLREPG-UHFFFAOYSA-N
MW381.46 g/mol
LogP2.51
Rot. Bonds4

About 3-[4-(2-methyl-3-pyridinyl)-1,3-thiazol-2-yl]-5-morpholin-4-ylpyridine-2-carboxamide

3-[4-(2-methyl-3-pyridinyl)-1,3-thiazol-2-yl]-5-morpholin-4-ylpyridine-2-carboxamide (PubChem CID 175867067) has the molecular formula C19H19N5O2S and a molecular weight of 381.46 g/mol. Its IUPAC name is 3-[4-(2-methyl-3-pyridinyl)-1,3-thiazol-2-yl]-5-morpholin-4-ylpyridine-2-carboxamide.

Molecular Properties

Compound Name3-[4-(2-methyl-3-pyridinyl)-1,3-thiazol-2-yl]-5-morpholin-4-ylpyridine-2-carboxamide
PubChem CID175867067
Molecular FormulaC19H19N5O2S
Molecular Weight381.46 g/mol
Exact Mass381.13
IUPAC Name3-[4-(2-methyl-3-pyridinyl)-1,3-thiazol-2-yl]-5-morpholin-4-ylpyridine-2-carboxamide
SMILESCc1ncccc1-c1csc(-c2cc(N3CCOCC3)cnc2C(N)=O)n1
InChIInChI=1S/C19H19N5O2S/c1-12-14(3-2-4-21-12)16-11-27-19(23-16)15-9-13(10-22-17(15)18(20)25)24-5-7-26-8-6-24/h2-4,9-11H,5-8H2,1H3,(H2,20,25)
InChIKeyCLYJMYBEVLREPG-UHFFFAOYSA-N
XLogP2.51
TPSA94.23 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.46
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

3-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]-5-[4-[(2S)-1-methylpyrrolidine-2-carbonyl]piperazin-1-yl]pyridine-2-carboxamide
CID 175867074
4-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]-2-morpholin-4-ylpyrimidine-5-carboxamide
CID 162386847
N-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]-5-morpholin-4-ylpyridine-2-carboxamide
CID 162387018
3-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]-5-(1-methylpiperidin-4-yl)oxypyridine-2-carboxamide
CID 175859708
2-(4-methoxyoxan-4-yl)-4-(2-methyl-3-pyridinyl)-1,3-thiazole
CID 122154767
5-chloro-3-morpholin-4-ylpyridine-2-carboxamide
CID 166656624
4-[[6-(2-methyl-3-pyridinyl)imidazo[2,1-b][1,3]thiazol-3-yl]methyl]morpholine
CID 59680036
N-[4-[[4-[7-(2-methyl-3-pyridinyl)-4-morpholin-4-ylpyrido[3,2-d]pyrimidin-2-yl]phenyl]carbamoylamino]phenyl]acetamide
CID 67514586
N-(4-morpholin-4-ylphenyl)-4-(4-pyridin-3-yl-1,3-thiazol-2-yl)-1,3-thiazol-2-amine
CID 171358589
1-(7-morpholin-4-yl-1-pyridin-2-ylindolizin-3-yl)ethanone
CID 70680607
1-[4-(2-methyl-3-pyridinyl)-6-morpholin-4-yl-2-pyridinyl]azetidin-3-ol
CID 151287061
2-[2-(2-chlorophenyl)-1,3-thiazol-4-yl]-N-(2-methyl-4-morpholin-4-ylphenyl)acetamide
CID 39267184

Frequently Asked Questions

What is the IUPAC name of 3-[4-(2-methyl-3-pyridinyl)-1,3-thiazol-2-yl]-5-morpholin-4-ylpyridine-2-carboxamide?
The IUPAC name of 3-[4-(2-methyl-3-pyridinyl)-1,3-thiazol-2-yl]-5-morpholin-4-ylpyridine-2-carboxamide (CID 175867067) is 3-[4-(2-methyl-3-pyridinyl)-1,3-thiazol-2-yl]-5-morpholin-4-ylpyridine-2-carboxamide.
What is the SMILES notation for 3-[4-(2-methyl-3-pyridinyl)-1,3-thiazol-2-yl]-5-morpholin-4-ylpyridine-2-carboxamide?
The canonical SMILES for 3-[4-(2-methyl-3-pyridinyl)-1,3-thiazol-2-yl]-5-morpholin-4-ylpyridine-2-carboxamide is Cc1ncccc1-c1csc(-c2cc(N3CCOCC3)cnc2C(N)=O)n1.
What is the InChIKey of 3-[4-(2-methyl-3-pyridinyl)-1,3-thiazol-2-yl]-5-morpholin-4-ylpyridine-2-carboxamide?
The InChIKey is CLYJMYBEVLREPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N5O2S/c1-12-14(3-2-4-21-12)16-11-27-19(23-16)15-9-13(10-22-17(15)18(20)25)24-5-7-26-8-6-24/h2-4,9-11H,5-8H2,1H3,(H2,20,25).
What are the key properties of 3-[4-(2-methyl-3-pyridinyl)-1,3-thiazol-2-yl]-5-morpholin-4-ylpyridine-2-carboxamide?
3-[4-(2-methyl-3-pyridinyl)-1,3-thiazol-2-yl]-5-morpholin-4-ylpyridine-2-carboxamide has a molecular weight of 381.46 g/mol, XLogP of 2.51, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(2-methyl-3-pyridinyl)-1,3-thiazol-2-yl]-5-morpholin-4-ylpyridine-2-carboxamide is sourced from PubChem (CID 175867067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).