2-(dimethylamino)-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]pyridine-3-carboxamide

C21H23N5O2S — CID 38936617

IUPAC2-(dimethylamino)-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]pyridine-3-carboxamide
SMILESCN(C)c1ncccc1C(=O)Nc1ccc(-c2csc(N3CCOCC3)n2)cc1
InChIInChI=1S/C21H23N5O2S/c1-25(2)19-17(4-3-9-22-19)20(27)23-16-7-5-15(6-8-16)18-14-29-21(24-18)26-10-12-28-13-11-26/h3-9,14H,10-13H2,1-2H3,(H,23,27)
InChIKeyXQNIADWOSJJYCS-UHFFFAOYSA-N
MW409.52 g/mol
LogP3.36
Rot. Bonds5

About 2-(dimethylamino)-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]pyridine-3-carboxamide

2-(dimethylamino)-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]pyridine-3-carboxamide (PubChem CID 38936617) has the molecular formula C21H23N5O2S and a molecular weight of 409.52 g/mol. Its IUPAC name is 2-(dimethylamino)-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-(dimethylamino)-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]pyridine-3-carboxamide
PubChem CID38936617
Molecular FormulaC21H23N5O2S
Molecular Weight409.52 g/mol
Exact Mass409.16
IUPAC Name2-(dimethylamino)-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]pyridine-3-carboxamide
SMILESCN(C)c1ncccc1C(=O)Nc1ccc(-c2csc(N3CCOCC3)n2)cc1
InChIInChI=1S/C21H23N5O2S/c1-25(2)19-17(4-3-9-22-19)20(27)23-16-7-5-15(6-8-16)18-14-29-21(24-18)26-10-12-28-13-11-26/h3-9,14H,10-13H2,1-2H3,(H,23,27)
InChIKeyXQNIADWOSJJYCS-UHFFFAOYSA-N
XLogP3.36
TPSA70.59 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500409.52
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 2-(dimethylamino)-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]pyridine-3-carboxamide with MolForge

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Related Compounds

6-[[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]carbamoyl]pyridine-2-carboxylic acid
CID 167811855
2-(dimethylamino)-N-(2-morpholin-4-ylphenyl)pyridine-3-carboxamide
CID 110299292
2-(dimethylamino)-N-[4-(3-oxomorpholin-4-yl)phenyl]pyridine-3-carboxamide
CID 110617692
5-fluoro-2-methoxy-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]benzamide
CID 26012155
2-(dimethylamino)-N-(4-piperidin-1-ylphenyl)pyridine-3-carboxamide
CID 110299290
3-[4-(dimethylamino)phenyl]-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]propanamide
CID 18272653
N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]-1H-indazole-3-carboxamide
CID 41452060
2-methyl-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]-1H-indole-3-carboxamide
CID 24629987
2-chloro-2-fluoro-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]acetamide
CID 166427762
2-(dimethylamino)-N-[4-(4-methylpiperidin-1-yl)phenyl]pyridine-3-carboxamide
CID 110299291
3-fluoro-4-methoxy-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]benzamide
CID 41248355
2-(dimethylamino)-N-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]pyridine-3-carboxamide
CID 110302012

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]pyridine-3-carboxamide?
The IUPAC name of 2-(dimethylamino)-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]pyridine-3-carboxamide (CID 38936617) is 2-(dimethylamino)-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]pyridine-3-carboxamide.
What is the SMILES notation for 2-(dimethylamino)-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]pyridine-3-carboxamide?
The canonical SMILES for 2-(dimethylamino)-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]pyridine-3-carboxamide is CN(C)c1ncccc1C(=O)Nc1ccc(-c2csc(N3CCOCC3)n2)cc1.
What is the InChIKey of 2-(dimethylamino)-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]pyridine-3-carboxamide?
The InChIKey is XQNIADWOSJJYCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N5O2S/c1-25(2)19-17(4-3-9-22-19)20(27)23-16-7-5-15(6-8-16)18-14-29-21(24-18)26-10-12-28-13-11-26/h3-9,14H,10-13H2,1-2H3,(H,23,27).
What are the key properties of 2-(dimethylamino)-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]pyridine-3-carboxamide?
2-(dimethylamino)-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]pyridine-3-carboxamide has a molecular weight of 409.52 g/mol, XLogP of 3.36, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]pyridine-3-carboxamide is sourced from PubChem (CID 38936617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).