N-(5-methylsulfanyl-3-pyridinyl)-2,3-dihydroindole-1-carboxamide

C15H15N3OS — CID 67754562

IUPACN-(5-methylsulfanyl-3-pyridinyl)-2,3-dihydroindole-1-carboxamide
SMILESCSc1cncc(NC(=O)N2CCc3ccccc32)c1
InChIInChI=1S/C15H15N3OS/c1-20-13-8-12(9-16-10-13)17-15(19)18-7-6-11-4-2-3-5-14(11)18/h2-5,8-10H,6-7H2,1H3,(H,17,19)
InChIKeyZUYADEAUWZQAEV-UHFFFAOYSA-N
MW285.37 g/mol
LogP3.40
Rot. Bonds2

About N-(5-methylsulfanyl-3-pyridinyl)-2,3-dihydroindole-1-carboxamide

N-(5-methylsulfanyl-3-pyridinyl)-2,3-dihydroindole-1-carboxamide (PubChem CID 67754562) has the molecular formula C15H15N3OS and a molecular weight of 285.37 g/mol. Its IUPAC name is N-(5-methylsulfanyl-3-pyridinyl)-2,3-dihydroindole-1-carboxamide.

Molecular Properties

Compound NameN-(5-methylsulfanyl-3-pyridinyl)-2,3-dihydroindole-1-carboxamide
PubChem CID67754562
Molecular FormulaC15H15N3OS
Molecular Weight285.37 g/mol
Exact Mass285.09
IUPAC NameN-(5-methylsulfanyl-3-pyridinyl)-2,3-dihydroindole-1-carboxamide
SMILESCSc1cncc(NC(=O)N2CCc3ccccc32)c1
InChIInChI=1S/C15H15N3OS/c1-20-13-8-12(9-16-10-13)17-15(19)18-7-6-11-4-2-3-5-14(11)18/h2-5,8-10H,6-7H2,1H3,(H,17,19)
InChIKeyZUYADEAUWZQAEV-UHFFFAOYSA-N
XLogP3.40
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.37
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3,4-dimethylphenyl)-2,3-dihydroindole-1-carboxamide
CID 6470011
N-(3,4-difluorophenyl)-2,3-dihydroindole-1-carboxamide
CID 108991230
N-pyridin-3-yl-2,3,4,5-tetrahydro-1-benzazepine-1-carboxamide
CID 166316460
N-(4-aminophenyl)-2,3-dihydroindole-1-carboxamide
CID 43469027
CID 144672697
CID 144672697
2-(2,3-dihydroindole-1-carbonyl)-N-(3-methylsulfanylphenyl)cyclohexane-1-carboxamide
CID 46421494
[5-(cyclopropylamino)-3-pyridinyl]-(2,3-dihydroindol-1-yl)methanone
CID 109223844
N-(2-fluorophenyl)-2,3-dihydroindole-1-carboxamide
CID 6468631
2-(3,4-dihydro-2H-quinolin-1-yl)-N-(3-methylsulfanylphenyl)-2-oxoacetamide
CID 108505619
N-(4-nitrophenyl)-2,3-dihydroindole-1-carboxamide
CID 2897905
1-[(2R)-1-(2,3-dihydroindol-1-yl)-3-methyl-1-oxobutan-2-yl]-3-(3-methylsulfanylphenyl)urea
CID 92881417
N-(2-ethylphenyl)-2,3-dihydroindole-1-carboxamide
CID 6468642

Frequently Asked Questions

What is the IUPAC name of N-(5-methylsulfanyl-3-pyridinyl)-2,3-dihydroindole-1-carboxamide?
The IUPAC name of N-(5-methylsulfanyl-3-pyridinyl)-2,3-dihydroindole-1-carboxamide (CID 67754562) is N-(5-methylsulfanyl-3-pyridinyl)-2,3-dihydroindole-1-carboxamide.
What is the SMILES notation for N-(5-methylsulfanyl-3-pyridinyl)-2,3-dihydroindole-1-carboxamide?
The canonical SMILES for N-(5-methylsulfanyl-3-pyridinyl)-2,3-dihydroindole-1-carboxamide is CSc1cncc(NC(=O)N2CCc3ccccc32)c1.
What is the InChIKey of N-(5-methylsulfanyl-3-pyridinyl)-2,3-dihydroindole-1-carboxamide?
The InChIKey is ZUYADEAUWZQAEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3OS/c1-20-13-8-12(9-16-10-13)17-15(19)18-7-6-11-4-2-3-5-14(11)18/h2-5,8-10H,6-7H2,1H3,(H,17,19).
What are the key properties of N-(5-methylsulfanyl-3-pyridinyl)-2,3-dihydroindole-1-carboxamide?
N-(5-methylsulfanyl-3-pyridinyl)-2,3-dihydroindole-1-carboxamide has a molecular weight of 285.37 g/mol, XLogP of 3.40, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methylsulfanyl-3-pyridinyl)-2,3-dihydroindole-1-carboxamide is sourced from PubChem (CID 67754562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).