4-(diethylamino)-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)benzamide

C19H20N4OS — CID 4142843

IUPAC4-(diethylamino)-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)benzamide
SMILESCCN(CC)c1ccc(C(=O)Nc2nc(-c3cccnc3)cs2)cc1
InChIInChI=1S/C19H20N4OS/c1-3-23(4-2)16-9-7-14(8-10-16)18(24)22-19-21-17(13-25-19)15-6-5-11-20-12-15/h5-13H,3-4H2,1-2H3,(H,21,22,24)
InChIKeyYBGVFPYRDTWUJV-UHFFFAOYSA-N
MW352.46 g/mol
LogP4.30
Rot. Bonds6

About 4-(diethylamino)-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)benzamide

4-(diethylamino)-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)benzamide (PubChem CID 4142843) has the molecular formula C19H20N4OS and a molecular weight of 352.46 g/mol. Its IUPAC name is 4-(diethylamino)-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name4-(diethylamino)-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)benzamide
PubChem CID4142843
Molecular FormulaC19H20N4OS
Molecular Weight352.46 g/mol
Exact Mass352.14
IUPAC Name4-(diethylamino)-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)benzamide
SMILESCCN(CC)c1ccc(C(=O)Nc2nc(-c3cccnc3)cs2)cc1
InChIInChI=1S/C19H20N4OS/c1-3-23(4-2)16-9-7-14(8-10-16)18(24)22-19-21-17(13-25-19)15-6-5-11-20-12-15/h5-13H,3-4H2,1-2H3,(H,21,22,24)
InChIKeyYBGVFPYRDTWUJV-UHFFFAOYSA-N
XLogP4.30
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.46
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(diethylaminomethyl)-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)benzamide
CID 43070031
4-acetamido-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)benzamide
CID 2463732
4-ethylsulfonyl-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)benzamide
CID 22581447
4-(diethylamino)-N-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]benzamide
CID 4646217
6-methyl-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide
CID 18151055
N-(4-pyridin-3-yl-1,3-thiazol-2-yl)-4-pyrrol-1-ylbenzamide
CID 17450848
4-(diethylamino)-N-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3-thiazol-2-yl]benzamide
CID 4245052
4-[methyl(propan-2-yl)sulfamoyl]-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)benzamide
CID 44993047
4-morpholin-4-yl-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)benzamide
CID 162386909
4-ethyl-5-methyl-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)thiophene-2-carboxamide
CID 40676303
3-methoxy-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)thiophene-2-carboxamide
CID 110446009
2-hydroxy-3,4-dimethyl-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)benzamide
CID 78895805

Frequently Asked Questions

What is the IUPAC name of 4-(diethylamino)-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)benzamide?
The IUPAC name of 4-(diethylamino)-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)benzamide (CID 4142843) is 4-(diethylamino)-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 4-(diethylamino)-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 4-(diethylamino)-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)benzamide is CCN(CC)c1ccc(C(=O)Nc2nc(-c3cccnc3)cs2)cc1.
What is the InChIKey of 4-(diethylamino)-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)benzamide?
The InChIKey is YBGVFPYRDTWUJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4OS/c1-3-23(4-2)16-9-7-14(8-10-16)18(24)22-19-21-17(13-25-19)15-6-5-11-20-12-15/h5-13H,3-4H2,1-2H3,(H,21,22,24).
What are the key properties of 4-(diethylamino)-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)benzamide?
4-(diethylamino)-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)benzamide has a molecular weight of 352.46 g/mol, XLogP of 4.30, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(diethylamino)-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 4142843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).