N-(4H-indeno[1,2-d][1,3]thiazol-2-yl)pentanamide

C15H16N2OS — CID 5197316

IUPACN-(4H-indeno[1,2-d][1,3]thiazol-2-yl)pentanamide
SMILESCCCCC(=O)Nc1nc2c(s1)Cc1ccccc1-2
InChIInChI=1S/C15H16N2OS/c1-2-3-8-13(18)16-15-17-14-11-7-5-4-6-10(11)9-12(14)19-15/h4-7H,2-3,8-9H2,1H3,(H,16,17,18)
InChIKeyVGXMMEFTDKEXOJ-UHFFFAOYSA-N
MW272.37 g/mol
LogP3.84
Rot. Bonds4

About N-(4H-indeno[1,2-d][1,3]thiazol-2-yl)pentanamide

N-(4H-indeno[1,2-d][1,3]thiazol-2-yl)pentanamide (PubChem CID 5197316) has the molecular formula C15H16N2OS and a molecular weight of 272.37 g/mol. Its IUPAC name is N-(4H-indeno[1,2-d][1,3]thiazol-2-yl)pentanamide.

Molecular Properties

Compound NameN-(4H-indeno[1,2-d][1,3]thiazol-2-yl)pentanamide
PubChem CID5197316
Molecular FormulaC15H16N2OS
Molecular Weight272.37 g/mol
Exact Mass272.10
IUPAC NameN-(4H-indeno[1,2-d][1,3]thiazol-2-yl)pentanamide
SMILESCCCCC(=O)Nc1nc2c(s1)Cc1ccccc1-2
InChIInChI=1S/C15H16N2OS/c1-2-3-8-13(18)16-15-17-14-11-7-5-4-6-10(11)9-12(14)19-15/h4-7H,2-3,8-9H2,1H3,(H,16,17,18)
InChIKeyVGXMMEFTDKEXOJ-UHFFFAOYSA-N
XLogP3.84
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 ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4H-indeno[1,2-d][1,3]thiazol-2-yl)pentanamide?
The IUPAC name of N-(4H-indeno[1,2-d][1,3]thiazol-2-yl)pentanamide (CID 5197316) is N-(4H-indeno[1,2-d][1,3]thiazol-2-yl)pentanamide.
What is the SMILES notation for N-(4H-indeno[1,2-d][1,3]thiazol-2-yl)pentanamide?
The canonical SMILES for N-(4H-indeno[1,2-d][1,3]thiazol-2-yl)pentanamide is CCCCC(=O)Nc1nc2c(s1)Cc1ccccc1-2.
What is the InChIKey of N-(4H-indeno[1,2-d][1,3]thiazol-2-yl)pentanamide?
The InChIKey is VGXMMEFTDKEXOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2OS/c1-2-3-8-13(18)16-15-17-14-11-7-5-4-6-10(11)9-12(14)19-15/h4-7H,2-3,8-9H2,1H3,(H,16,17,18).
What are the key properties of N-(4H-indeno[1,2-d][1,3]thiazol-2-yl)pentanamide?
N-(4H-indeno[1,2-d][1,3]thiazol-2-yl)pentanamide has a molecular weight of 272.37 g/mol, XLogP of 3.84, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4H-indeno[1,2-d][1,3]thiazol-2-yl)pentanamide is sourced from PubChem (CID 5197316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).