4-amino-N-(2,3-dihydro-1H-inden-2-yl)-5-methylthiophene-2-carboxamide

C15H16N2OS — CID 107843269

IUPAC4-amino-N-(2,3-dihydro-1H-inden-2-yl)-5-methylthiophene-2-carboxamide
SMILESCc1sc(C(=O)NC2Cc3ccccc3C2)cc1N
InChIInChI=1S/C15H16N2OS/c1-9-13(16)8-14(19-9)15(18)17-12-6-10-4-2-3-5-11(10)7-12/h2-5,8,12H,6-7,16H2,1H3,(H,17,18)
InChIKeyMKKQQSWPRSUHEU-UHFFFAOYSA-N
MW272.37 g/mol
LogP2.54
Rot. Bonds2

About 4-amino-N-(2,3-dihydro-1H-inden-2-yl)-5-methylthiophene-2-carboxamide

4-amino-N-(2,3-dihydro-1H-inden-2-yl)-5-methylthiophene-2-carboxamide (PubChem CID 107843269) has the molecular formula C15H16N2OS and a molecular weight of 272.37 g/mol. Its IUPAC name is 4-amino-N-(2,3-dihydro-1H-inden-2-yl)-5-methylthiophene-2-carboxamide.

Molecular Properties

Compound Name4-amino-N-(2,3-dihydro-1H-inden-2-yl)-5-methylthiophene-2-carboxamide
PubChem CID107843269
Molecular FormulaC15H16N2OS
Molecular Weight272.37 g/mol
Exact Mass272.10
IUPAC Name4-amino-N-(2,3-dihydro-1H-inden-2-yl)-5-methylthiophene-2-carboxamide
SMILESCc1sc(C(=O)NC2Cc3ccccc3C2)cc1N
InChIInChI=1S/C15H16N2OS/c1-9-13(16)8-14(19-9)15(18)17-12-6-10-4-2-3-5-11(10)7-12/h2-5,8,12H,6-7,16H2,1H3,(H,17,18)
InChIKeyMKKQQSWPRSUHEU-UHFFFAOYSA-N
XLogP2.54
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.37
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(2,3-dihydro-1H-inden-2-yl)-5-methylthiophene-2-carboxamide?
The IUPAC name of 4-amino-N-(2,3-dihydro-1H-inden-2-yl)-5-methylthiophene-2-carboxamide (CID 107843269) is 4-amino-N-(2,3-dihydro-1H-inden-2-yl)-5-methylthiophene-2-carboxamide.
What is the SMILES notation for 4-amino-N-(2,3-dihydro-1H-inden-2-yl)-5-methylthiophene-2-carboxamide?
The canonical SMILES for 4-amino-N-(2,3-dihydro-1H-inden-2-yl)-5-methylthiophene-2-carboxamide is Cc1sc(C(=O)NC2Cc3ccccc3C2)cc1N.
What is the InChIKey of 4-amino-N-(2,3-dihydro-1H-inden-2-yl)-5-methylthiophene-2-carboxamide?
The InChIKey is MKKQQSWPRSUHEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2OS/c1-9-13(16)8-14(19-9)15(18)17-12-6-10-4-2-3-5-11(10)7-12/h2-5,8,12H,6-7,16H2,1H3,(H,17,18).
What are the key properties of 4-amino-N-(2,3-dihydro-1H-inden-2-yl)-5-methylthiophene-2-carboxamide?
4-amino-N-(2,3-dihydro-1H-inden-2-yl)-5-methylthiophene-2-carboxamide has a molecular weight of 272.37 g/mol, XLogP of 2.54, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(2,3-dihydro-1H-inden-2-yl)-5-methylthiophene-2-carboxamide is sourced from PubChem (CID 107843269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).