N-benzyl-2-methyl-6-thiophen-2-ylpyridine-3-carboxamide

C18H16N2OS — CID 39428057

IUPACN-benzyl-2-methyl-6-thiophen-2-ylpyridine-3-carboxamide
SMILESCc1nc(-c2cccs2)ccc1C(=O)NCc1ccccc1
InChIInChI=1S/C18H16N2OS/c1-13-15(9-10-16(20-13)17-8-5-11-22-17)18(21)19-12-14-6-3-2-4-7-14/h2-11H,12H2,1H3,(H,19,21)
InChIKeyNZAYTIMNHGQZKX-UHFFFAOYSA-N
MW308.41 g/mol
LogP4.05
Rot. Bonds4

About N-benzyl-2-methyl-6-thiophen-2-ylpyridine-3-carboxamide

N-benzyl-2-methyl-6-thiophen-2-ylpyridine-3-carboxamide (PubChem CID 39428057) has the molecular formula C18H16N2OS and a molecular weight of 308.41 g/mol. Its IUPAC name is N-benzyl-2-methyl-6-thiophen-2-ylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-benzyl-2-methyl-6-thiophen-2-ylpyridine-3-carboxamide
PubChem CID39428057
Molecular FormulaC18H16N2OS
Molecular Weight308.41 g/mol
Exact Mass308.10
IUPAC NameN-benzyl-2-methyl-6-thiophen-2-ylpyridine-3-carboxamide
SMILESCc1nc(-c2cccs2)ccc1C(=O)NCc1ccccc1
InChIInChI=1S/C18H16N2OS/c1-13-15(9-10-16(20-13)17-8-5-11-22-17)18(21)19-12-14-6-3-2-4-7-14/h2-11H,12H2,1H3,(H,19,21)
InChIKeyNZAYTIMNHGQZKX-UHFFFAOYSA-N
XLogP4.05
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.41
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-N-(2-pyridin-2-ylethyl)-6-thiophen-2-ylpyridine-3-carboxamide
CID 39897614
N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-2-methyl-6-thiophen-2-ylpyridine-3-carboxamide
CID 78835348
1-(2-methyl-6-thiophen-2-yl-3-pyridinyl)ethanone
CID 66490371
N,2-dimethyl-N-phenyl-6-thiophen-2-ylpyridine-3-carboxamide
CID 39428121
2-methyl-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-6-thiophen-2-ylpyridine-3-carboxamide
CID 33308674
2-[ethyl-(2-methyl-6-thiophen-2-ylpyridine-3-carbonyl)amino]acetic acid
CID 120519701
2-(benzylamino)-4-methyl-N-(thiophen-2-ylmethyl)pyrimidine-5-carboxamide
CID 20959702
2-methyl-6-phenyl-N-(2-thiophen-2-ylethyl)pyridine-3-carboxamide
CID 24532142
N-[[(2R,3R)-3-hydroxy-2-methyloxolan-3-yl]methyl]-2-methyl-6-thiophen-2-ylpyridine-3-carboxamide
CID 100735307
4-[methyl-(2-methyl-6-thiophen-2-ylpyridine-3-carbonyl)amino]butanoic acid
CID 120513830
N-benzyl-4-thiophen-2-ylbenzamide
CID 3677900
N-benzyl-2,4-dimethylpyrimidine-5-carboxamide
CID 53007173

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-methyl-6-thiophen-2-ylpyridine-3-carboxamide?
The IUPAC name of N-benzyl-2-methyl-6-thiophen-2-ylpyridine-3-carboxamide (CID 39428057) is N-benzyl-2-methyl-6-thiophen-2-ylpyridine-3-carboxamide.
What is the SMILES notation for N-benzyl-2-methyl-6-thiophen-2-ylpyridine-3-carboxamide?
The canonical SMILES for N-benzyl-2-methyl-6-thiophen-2-ylpyridine-3-carboxamide is Cc1nc(-c2cccs2)ccc1C(=O)NCc1ccccc1.
What is the InChIKey of N-benzyl-2-methyl-6-thiophen-2-ylpyridine-3-carboxamide?
The InChIKey is NZAYTIMNHGQZKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2OS/c1-13-15(9-10-16(20-13)17-8-5-11-22-17)18(21)19-12-14-6-3-2-4-7-14/h2-11H,12H2,1H3,(H,19,21).
What are the key properties of N-benzyl-2-methyl-6-thiophen-2-ylpyridine-3-carboxamide?
N-benzyl-2-methyl-6-thiophen-2-ylpyridine-3-carboxamide has a molecular weight of 308.41 g/mol, XLogP of 4.05, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-methyl-6-thiophen-2-ylpyridine-3-carboxamide is sourced from PubChem (CID 39428057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).