N-(6-methyl-2-pyridinyl)-4-(methylsulfanylmethyl)benzamide

C15H16N2OS — CID 18107198

IUPACN-(6-methyl-2-pyridinyl)-4-(methylsulfanylmethyl)benzamide
SMILESCSCc1ccc(C(=O)Nc2cccc(C)n2)cc1
InChIInChI=1S/C15H16N2OS/c1-11-4-3-5-14(16-11)17-15(18)13-8-6-12(7-9-13)10-19-2/h3-9H,10H2,1-2H3,(H,16,17,18)
InChIKeyDCQSAUGDEJNVIM-UHFFFAOYSA-N
MW272.37 g/mol
LogP3.51
Rot. Bonds4

About N-(6-methyl-2-pyridinyl)-4-(methylsulfanylmethyl)benzamide

N-(6-methyl-2-pyridinyl)-4-(methylsulfanylmethyl)benzamide (PubChem CID 18107198) has the molecular formula C15H16N2OS and a molecular weight of 272.37 g/mol. Its IUPAC name is N-(6-methyl-2-pyridinyl)-4-(methylsulfanylmethyl)benzamide.

Molecular Properties

Compound NameN-(6-methyl-2-pyridinyl)-4-(methylsulfanylmethyl)benzamide
PubChem CID18107198
Molecular FormulaC15H16N2OS
Molecular Weight272.37 g/mol
Exact Mass272.10
IUPAC NameN-(6-methyl-2-pyridinyl)-4-(methylsulfanylmethyl)benzamide
SMILESCSCc1ccc(C(=O)Nc2cccc(C)n2)cc1
InChIInChI=1S/C15H16N2OS/c1-11-4-3-5-14(16-11)17-15(18)13-8-6-12(7-9-13)10-19-2/h3-9H,10H2,1-2H3,(H,16,17,18)
InChIKeyDCQSAUGDEJNVIM-UHFFFAOYSA-N
XLogP3.51
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.37
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(1,3-dioxoisoindol-2-yl)methyl]-N-(6-methyl-2-pyridinyl)benzamide
CID 32700452
N-(6-methyl-2-pyridinyl)-4-phenylmethoxybenzamide
CID 35036020
4-[(2-bromophenoxy)methyl]-N-(6-methyl-2-pyridinyl)benzamide
CID 1039541
3,4-diamino-N-(6-methyl-2-pyridinyl)benzamide
CID 22411201
N-(6-methyl-2-pyridinyl)-4-(pyridin-4-ylmethoxy)benzamide
CID 36998699
3-methyl-N-(6-methyl-2-pyridinyl)benzamide
CID 966005
4-(4-fluorophenoxy)-N-(6-methyl-2-pyridinyl)benzamide
CID 35505697
N-(6-methyl-2-pyridinyl)-4-pyrazol-1-ylbenzamide
CID 35505245
4-(methylsulfanylmethyl)-N-quinolin-8-ylbenzamide
CID 31289054
6-amino-N-(6-methyl-2-pyridinyl)pyridine-3-carboxamide
CID 62060328
N-(6-methyl-2-pyridinyl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide
CID 708615
3-benzamido-4-methyl-N-(6-methyl-2-pyridinyl)benzamide
CID 46411335

Frequently Asked Questions

What is the IUPAC name of N-(6-methyl-2-pyridinyl)-4-(methylsulfanylmethyl)benzamide?
The IUPAC name of N-(6-methyl-2-pyridinyl)-4-(methylsulfanylmethyl)benzamide (CID 18107198) is N-(6-methyl-2-pyridinyl)-4-(methylsulfanylmethyl)benzamide.
What is the SMILES notation for N-(6-methyl-2-pyridinyl)-4-(methylsulfanylmethyl)benzamide?
The canonical SMILES for N-(6-methyl-2-pyridinyl)-4-(methylsulfanylmethyl)benzamide is CSCc1ccc(C(=O)Nc2cccc(C)n2)cc1.
What is the InChIKey of N-(6-methyl-2-pyridinyl)-4-(methylsulfanylmethyl)benzamide?
The InChIKey is DCQSAUGDEJNVIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2OS/c1-11-4-3-5-14(16-11)17-15(18)13-8-6-12(7-9-13)10-19-2/h3-9H,10H2,1-2H3,(H,16,17,18).
What are the key properties of N-(6-methyl-2-pyridinyl)-4-(methylsulfanylmethyl)benzamide?
N-(6-methyl-2-pyridinyl)-4-(methylsulfanylmethyl)benzamide has a molecular weight of 272.37 g/mol, XLogP of 3.51, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methyl-2-pyridinyl)-4-(methylsulfanylmethyl)benzamide is sourced from PubChem (CID 18107198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).