6-(3-chlorophenyl)-5-methyl-N-[2-(1,3-thiazol-2-yl)propan-2-yl]pyridine-2-carboxamide

C19H18ClN3OS — CID 71105565

IUPAC6-(3-chlorophenyl)-5-methyl-N-[2-(1,3-thiazol-2-yl)propan-2-yl]pyridine-2-carboxamide
SMILESCc1ccc(C(=O)NC(C)(C)c2nccs2)nc1-c1cccc(Cl)c1
InChIInChI=1S/C19H18ClN3OS/c1-12-7-8-15(22-16(12)13-5-4-6-14(20)11-13)17(24)23-19(2,3)18-21-9-10-25-18/h4-11H,1-3H3,(H,23,24)
InChIKeyAJLBNQYWVZCLRT-UHFFFAOYSA-N
MW371.89 g/mol
LogP4.83
Rot. Bonds4

About 6-(3-chlorophenyl)-5-methyl-N-[2-(1,3-thiazol-2-yl)propan-2-yl]pyridine-2-carboxamide

6-(3-chlorophenyl)-5-methyl-N-[2-(1,3-thiazol-2-yl)propan-2-yl]pyridine-2-carboxamide (PubChem CID 71105565) has the molecular formula C19H18ClN3OS and a molecular weight of 371.89 g/mol. Its IUPAC name is 6-(3-chlorophenyl)-5-methyl-N-[2-(1,3-thiazol-2-yl)propan-2-yl]pyridine-2-carboxamide.

Molecular Properties

Compound Name6-(3-chlorophenyl)-5-methyl-N-[2-(1,3-thiazol-2-yl)propan-2-yl]pyridine-2-carboxamide
PubChem CID71105565
Molecular FormulaC19H18ClN3OS
Molecular Weight371.89 g/mol
Exact Mass371.09
IUPAC Name6-(3-chlorophenyl)-5-methyl-N-[2-(1,3-thiazol-2-yl)propan-2-yl]pyridine-2-carboxamide
SMILESCc1ccc(C(=O)NC(C)(C)c2nccs2)nc1-c1cccc(Cl)c1
InChIInChI=1S/C19H18ClN3OS/c1-12-7-8-15(22-16(12)13-5-4-6-14(20)11-13)17(24)23-19(2,3)18-21-9-10-25-18/h4-11H,1-3H3,(H,23,24)
InChIKeyAJLBNQYWVZCLRT-UHFFFAOYSA-N
XLogP4.83
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.89
LogP ≤ 54.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-(3-chlorophenyl)-5-methyl-N-[2-(1,3-thiazol-2-yl)propan-2-yl]pyridine-2-carboxamide with MolForge

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Related Compounds

2-(3-chlorophenyl)-4-methyl-5-[(2R)-1-[(1,3-thiazol-2-yl)carbonyl]pyrrolidin-2-yl]pyridine
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6-Chloro-3-[2-(pyridin-4-yl)-1,3-thiazol-4-yl]-1,2-dihydroquinolin-2-one
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(3,4-Dichlorophenyl)-[4-fluoro-4-[[[6-(1,3-thiazol-2-yl)-2-pyridinyl]methylamino]methyl]piperidin-1-yl]methanone
CID 10743303
(3,4-Dichlorophenyl)-[4-[[[6-(1,3-thiazol-2-yl)-2-pyridinyl]methylamino]methyl]piperidin-1-yl]methanone
CID 10813865
N-(4-chlorophenyl)-4-[2-(pyridin-4-yl)ethyl]-1,3-thiazole-5-carboxamide
CID 23644830
Pmid21757343C30
CID 56663548
N4-(4-chlorobenzyl)-2-(3-pyridyl)-1,3-thiazole-4-carboxamide
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N-(4-chlorophenyl)-2-(4-pyridinyl)-1,3-thiazole-4-carboxamide
CID 1483683
3-Chloro-N-(4-pyridin-2-yl-thiazol-2-yl)-benzamide
CID 3534313
N-{2-[2-(pyridin-3-yl)-1,3-thiazol-4-yl]ethyl}benzamide
CID 7119148
2-[(2,6-dichlorophenyl)methyl]-N-[6-(trifluoromethyl)pyridin-3-yl]-1,3-thiazole-4-carboxamide
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Frequently Asked Questions

What is the IUPAC name of 6-(3-chlorophenyl)-5-methyl-N-[2-(1,3-thiazol-2-yl)propan-2-yl]pyridine-2-carboxamide?
The IUPAC name of 6-(3-chlorophenyl)-5-methyl-N-[2-(1,3-thiazol-2-yl)propan-2-yl]pyridine-2-carboxamide (CID 71105565) is 6-(3-chlorophenyl)-5-methyl-N-[2-(1,3-thiazol-2-yl)propan-2-yl]pyridine-2-carboxamide.
What is the SMILES notation for 6-(3-chlorophenyl)-5-methyl-N-[2-(1,3-thiazol-2-yl)propan-2-yl]pyridine-2-carboxamide?
The canonical SMILES for 6-(3-chlorophenyl)-5-methyl-N-[2-(1,3-thiazol-2-yl)propan-2-yl]pyridine-2-carboxamide is Cc1ccc(C(=O)NC(C)(C)c2nccs2)nc1-c1cccc(Cl)c1.
What is the InChIKey of 6-(3-chlorophenyl)-5-methyl-N-[2-(1,3-thiazol-2-yl)propan-2-yl]pyridine-2-carboxamide?
The InChIKey is AJLBNQYWVZCLRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18ClN3OS/c1-12-7-8-15(22-16(12)13-5-4-6-14(20)11-13)17(24)23-19(2,3)18-21-9-10-25-18/h4-11H,1-3H3,(H,23,24).
What are the key properties of 6-(3-chlorophenyl)-5-methyl-N-[2-(1,3-thiazol-2-yl)propan-2-yl]pyridine-2-carboxamide?
6-(3-chlorophenyl)-5-methyl-N-[2-(1,3-thiazol-2-yl)propan-2-yl]pyridine-2-carboxamide has a molecular weight of 371.89 g/mol, XLogP of 4.83, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-chlorophenyl)-5-methyl-N-[2-(1,3-thiazol-2-yl)propan-2-yl]pyridine-2-carboxamide is sourced from PubChem (CID 71105565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).