2-(1,6-dimethyl-4,9-dihydro-3H-indeno[2,1-c]pyran-1-yl)acetamide

C16H19NO2 — CID 21495290

IUPAC2-(1,6-dimethyl-4,9-dihydro-3H-indeno[2,1-c]pyran-1-yl)acetamide
SMILESCc1ccc2c(c1)C1=C(C2)C(C)(CC(N)=O)OCC1
InChIInChI=1S/C16H19NO2/c1-10-3-4-11-8-14-12(13(11)7-10)5-6-19-16(14,2)9-15(17)18/h3-4,7H,5-6,8-9H2,1-2H3,(H2,17,18)
InChIKeySTASTGVZRSEACK-UHFFFAOYSA-N
MW257.33 g/mol
LogP2.36
Rot. Bonds2

About 2-(1,6-dimethyl-4,9-dihydro-3H-indeno[2,1-c]pyran-1-yl)acetamide

2-(1,6-dimethyl-4,9-dihydro-3H-indeno[2,1-c]pyran-1-yl)acetamide (PubChem CID 21495290) has the molecular formula C16H19NO2 and a molecular weight of 257.33 g/mol. Its IUPAC name is 2-(1,6-dimethyl-4,9-dihydro-3H-indeno[2,1-c]pyran-1-yl)acetamide.

Molecular Properties

Compound Name2-(1,6-dimethyl-4,9-dihydro-3H-indeno[2,1-c]pyran-1-yl)acetamide
PubChem CID21495290
Molecular FormulaC16H19NO2
Molecular Weight257.33 g/mol
Exact Mass257.14
IUPAC Name2-(1,6-dimethyl-4,9-dihydro-3H-indeno[2,1-c]pyran-1-yl)acetamide
SMILESCc1ccc2c(c1)C1=C(C2)C(C)(CC(N)=O)OCC1
InChIInChI=1S/C16H19NO2/c1-10-3-4-11-8-14-12(13(11)7-10)5-6-19-16(14,2)9-15(17)18/h3-4,7H,5-6,8-9H2,1-2H3,(H2,17,18)
InChIKeySTASTGVZRSEACK-UHFFFAOYSA-N
XLogP2.36
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.33
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(1,6-dimethyl-4,9-dihydro-3H-indeno[2,1-c]pyran-1-yl)acetamide?
The IUPAC name of 2-(1,6-dimethyl-4,9-dihydro-3H-indeno[2,1-c]pyran-1-yl)acetamide (CID 21495290) is 2-(1,6-dimethyl-4,9-dihydro-3H-indeno[2,1-c]pyran-1-yl)acetamide.
What is the SMILES notation for 2-(1,6-dimethyl-4,9-dihydro-3H-indeno[2,1-c]pyran-1-yl)acetamide?
The canonical SMILES for 2-(1,6-dimethyl-4,9-dihydro-3H-indeno[2,1-c]pyran-1-yl)acetamide is Cc1ccc2c(c1)C1=C(C2)C(C)(CC(N)=O)OCC1.
What is the InChIKey of 2-(1,6-dimethyl-4,9-dihydro-3H-indeno[2,1-c]pyran-1-yl)acetamide?
The InChIKey is STASTGVZRSEACK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO2/c1-10-3-4-11-8-14-12(13(11)7-10)5-6-19-16(14,2)9-15(17)18/h3-4,7H,5-6,8-9H2,1-2H3,(H2,17,18).
What are the key properties of 2-(1,6-dimethyl-4,9-dihydro-3H-indeno[2,1-c]pyran-1-yl)acetamide?
2-(1,6-dimethyl-4,9-dihydro-3H-indeno[2,1-c]pyran-1-yl)acetamide has a molecular weight of 257.33 g/mol, XLogP of 2.36, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,6-dimethyl-4,9-dihydro-3H-indeno[2,1-c]pyran-1-yl)acetamide is sourced from PubChem (CID 21495290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).