2-phenyl-3-pyridin-2-yl-N-[4-(1,3-thiazol-2-yl)phenyl]propanamide

C23H19N3OS — CID 110628941

IUPAC2-phenyl-3-pyridin-2-yl-N-[4-(1,3-thiazol-2-yl)phenyl]propanamide
SMILESO=C(Nc1ccc(-c2nccs2)cc1)C(Cc1ccccn1)c1ccccc1
InChIInChI=1S/C23H19N3OS/c27-22(26-19-11-9-18(10-12-19)23-25-14-15-28-23)21(17-6-2-1-3-7-17)16-20-8-4-5-13-24-20/h1-15,21H,16H2,(H,26,27)
InChIKeyJJTQHMJBTZGQNQ-UHFFFAOYSA-N
MW385.49 g/mol
LogP5.17
Rot. Bonds6

About 2-phenyl-3-pyridin-2-yl-N-[4-(1,3-thiazol-2-yl)phenyl]propanamide

2-phenyl-3-pyridin-2-yl-N-[4-(1,3-thiazol-2-yl)phenyl]propanamide (PubChem CID 110628941) has the molecular formula C23H19N3OS and a molecular weight of 385.49 g/mol. Its IUPAC name is 2-phenyl-3-pyridin-2-yl-N-[4-(1,3-thiazol-2-yl)phenyl]propanamide.

Molecular Properties

Compound Name2-phenyl-3-pyridin-2-yl-N-[4-(1,3-thiazol-2-yl)phenyl]propanamide
PubChem CID110628941
Molecular FormulaC23H19N3OS
Molecular Weight385.49 g/mol
Exact Mass385.12
IUPAC Name2-phenyl-3-pyridin-2-yl-N-[4-(1,3-thiazol-2-yl)phenyl]propanamide
SMILESO=C(Nc1ccc(-c2nccs2)cc1)C(Cc1ccccn1)c1ccccc1
InChIInChI=1S/C23H19N3OS/c27-22(26-19-11-9-18(10-12-19)23-25-14-15-28-23)21(17-6-2-1-3-7-17)16-20-8-4-5-13-24-20/h1-15,21H,16H2,(H,26,27)
InChIKeyJJTQHMJBTZGQNQ-UHFFFAOYSA-N
XLogP5.17
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500385.49
LogP ≤ 55.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(6-bromo-3-pyridinyl)-2-phenyl-3-pyridin-2-ylpropanamide
CID 110614697
2-phenyl-3-pyridin-2-yl-N-(pyridin-2-ylmethyl)propanamide
CID 110410528
4-(2-phenylbutanoylamino)-N-(1,3-thiazol-2-yl)benzamide
CID 17361450
(2R)-2-amino-N-[4-(1,3-thiazol-2-yl)phenyl]propanamide
CID 54995648
N-(1,3-benzodioxol-5-yl)-2-phenyl-3-pyridin-2-ylpropanamide
CID 110426267
(3R)-3-acetamido-3-phenyl-N-[4-(1,3-thiazol-2-yl)phenyl]propanamide
CID 9449805
N-(2-oxo-3H-1,3-benzoxazol-5-yl)-2-phenyl-3-pyridin-2-ylpropanamide
CID 110607882
N-(2-oxo-3H-1,3-benzoxazol-6-yl)-2-phenyl-3-pyridin-2-ylpropanamide
CID 110608109
N-cyclopentyl-2-phenyl-3-pyridin-2-ylpropanamide
CID 110407019
(2R)-2-amino-3,3-dimethyl-N-[4-(1,3-thiazol-2-yl)phenyl]butanamide
CID 103928998
4-amino-5-oxo-5-[4-(1,3-thiazol-2-yl)anilino]pentanoic acid
CID 64888719
2-phenyl-N-(1,3-thiazol-2-yl)butanamide
CID 2888884

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-3-pyridin-2-yl-N-[4-(1,3-thiazol-2-yl)phenyl]propanamide?
The IUPAC name of 2-phenyl-3-pyridin-2-yl-N-[4-(1,3-thiazol-2-yl)phenyl]propanamide (CID 110628941) is 2-phenyl-3-pyridin-2-yl-N-[4-(1,3-thiazol-2-yl)phenyl]propanamide.
What is the SMILES notation for 2-phenyl-3-pyridin-2-yl-N-[4-(1,3-thiazol-2-yl)phenyl]propanamide?
The canonical SMILES for 2-phenyl-3-pyridin-2-yl-N-[4-(1,3-thiazol-2-yl)phenyl]propanamide is O=C(Nc1ccc(-c2nccs2)cc1)C(Cc1ccccn1)c1ccccc1.
What is the InChIKey of 2-phenyl-3-pyridin-2-yl-N-[4-(1,3-thiazol-2-yl)phenyl]propanamide?
The InChIKey is JJTQHMJBTZGQNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N3OS/c27-22(26-19-11-9-18(10-12-19)23-25-14-15-28-23)21(17-6-2-1-3-7-17)16-20-8-4-5-13-24-20/h1-15,21H,16H2,(H,26,27).
What are the key properties of 2-phenyl-3-pyridin-2-yl-N-[4-(1,3-thiazol-2-yl)phenyl]propanamide?
2-phenyl-3-pyridin-2-yl-N-[4-(1,3-thiazol-2-yl)phenyl]propanamide has a molecular weight of 385.49 g/mol, XLogP of 5.17, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-3-pyridin-2-yl-N-[4-(1,3-thiazol-2-yl)phenyl]propanamide is sourced from PubChem (CID 110628941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).