N-(5-chloro-2-pyridinyl)-2-(2-methylphenyl)sulfanylacetamide

C14H13ClN2OS — CID 34135048

IUPACN-(5-chloro-2-pyridinyl)-2-(2-methylphenyl)sulfanylacetamide
SMILESCc1ccccc1SCC(=O)Nc1ccc(Cl)cn1
InChIInChI=1S/C14H13ClN2OS/c1-10-4-2-3-5-12(10)19-9-14(18)17-13-7-6-11(15)8-16-13/h2-8H,9H2,1H3,(H,16,17,18)
InChIKeyMTYACQMGVREVOQ-UHFFFAOYSA-N
MW292.79 g/mol
LogP3.77
Rot. Bonds4

About N-(5-chloro-2-pyridinyl)-2-(2-methylphenyl)sulfanylacetamide

N-(5-chloro-2-pyridinyl)-2-(2-methylphenyl)sulfanylacetamide (PubChem CID 34135048) has the molecular formula C14H13ClN2OS and a molecular weight of 292.79 g/mol. Its IUPAC name is N-(5-chloro-2-pyridinyl)-2-(2-methylphenyl)sulfanylacetamide.

Molecular Properties

Compound NameN-(5-chloro-2-pyridinyl)-2-(2-methylphenyl)sulfanylacetamide
PubChem CID34135048
Molecular FormulaC14H13ClN2OS
Molecular Weight292.79 g/mol
Exact Mass292.04
IUPAC NameN-(5-chloro-2-pyridinyl)-2-(2-methylphenyl)sulfanylacetamide
SMILESCc1ccccc1SCC(=O)Nc1ccc(Cl)cn1
InChIInChI=1S/C14H13ClN2OS/c1-10-4-2-3-5-12(10)19-9-14(18)17-13-7-6-11(15)8-16-13/h2-8H,9H2,1H3,(H,16,17,18)
InChIKeyMTYACQMGVREVOQ-UHFFFAOYSA-N
XLogP3.77
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.79
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-chloro-2-pyridinyl)-2-(2,5-dimethylphenyl)sulfanylacetamide
CID 2121854
6-[[2-(2-methylphenyl)sulfanylacetyl]amino]pyridine-3-carboxylic acid
CID 61318371
[(2S)-1-[(5-chloro-2-pyridinyl)amino]-1-oxopropan-2-yl] 2-(2-methylphenyl)sulfanylacetate
CID 7229608
N-[4-[2-[(5-chloro-2-pyridinyl)amino]-2-oxoethyl]sulfanylphenyl]-2-methylbenzamide
CID 22775889
N-(5-chloro-2-pyridinyl)-2-(2-methylphenyl)acetamide
CID 6464449
N-(5-chloro-2-pyridinyl)-2-pyridin-2-ylsulfanylacetamide
CID 3918454
2-(2-methylphenyl)sulfanyl-N-pyridin-4-ylacetamide
CID 4215609
N-(5-chloro-2-pyridinyl)-2-methylbenzamide
CID 758009
4-chloro-N-[2-[[2-(2-methylphenyl)sulfanylacetyl]amino]phenyl]benzamide
CID 31964988
[2-[(5-chloro-2-pyridinyl)amino]-2-oxoethyl] 2-(2-fluorophenyl)sulfanylacetate
CID 7355006
N-(5-chloro-2-pyridinyl)-2-[[4-(2-methylphenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide
CID 16536222
N-(5-chloro-2-pyridinyl)-2-[(3-chloro-2-pyridinyl)sulfanyl]acetamide
CID 51319436

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-pyridinyl)-2-(2-methylphenyl)sulfanylacetamide?
The IUPAC name of N-(5-chloro-2-pyridinyl)-2-(2-methylphenyl)sulfanylacetamide (CID 34135048) is N-(5-chloro-2-pyridinyl)-2-(2-methylphenyl)sulfanylacetamide.
What is the SMILES notation for N-(5-chloro-2-pyridinyl)-2-(2-methylphenyl)sulfanylacetamide?
The canonical SMILES for N-(5-chloro-2-pyridinyl)-2-(2-methylphenyl)sulfanylacetamide is Cc1ccccc1SCC(=O)Nc1ccc(Cl)cn1.
What is the InChIKey of N-(5-chloro-2-pyridinyl)-2-(2-methylphenyl)sulfanylacetamide?
The InChIKey is MTYACQMGVREVOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13ClN2OS/c1-10-4-2-3-5-12(10)19-9-14(18)17-13-7-6-11(15)8-16-13/h2-8H,9H2,1H3,(H,16,17,18).
What are the key properties of N-(5-chloro-2-pyridinyl)-2-(2-methylphenyl)sulfanylacetamide?
N-(5-chloro-2-pyridinyl)-2-(2-methylphenyl)sulfanylacetamide has a molecular weight of 292.79 g/mol, XLogP of 3.77, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-pyridinyl)-2-(2-methylphenyl)sulfanylacetamide is sourced from PubChem (CID 34135048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).