N-(2,3-dihydro-1H-inden-5-yl)-N-methylacetamide

C12H15NO — CID 115190982

IUPACN-(2,3-dihydro-1H-inden-5-yl)-N-methylacetamide
SMILESCC(=O)N(C)c1ccc2c(c1)CCC2
InChIInChI=1S/C12H15NO/c1-9(14)13(2)12-7-6-10-4-3-5-11(10)8-12/h6-8H,3-5H2,1-2H3
InChIKeyZGWHYFRPDPAJFY-UHFFFAOYSA-N
MW189.26 g/mol
LogP2.16
Rot. Bonds1

About N-(2,3-dihydro-1H-inden-5-yl)-N-methylacetamide

N-(2,3-dihydro-1H-inden-5-yl)-N-methylacetamide (PubChem CID 115190982) has the molecular formula C12H15NO and a molecular weight of 189.26 g/mol. Its IUPAC name is N-(2,3-dihydro-1H-inden-5-yl)-N-methylacetamide.

Molecular Properties

Compound NameN-(2,3-dihydro-1H-inden-5-yl)-N-methylacetamide
PubChem CID115190982
Molecular FormulaC12H15NO
Molecular Weight189.26 g/mol
Exact Mass189.12
IUPAC NameN-(2,3-dihydro-1H-inden-5-yl)-N-methylacetamide
SMILESCC(=O)N(C)c1ccc2c(c1)CCC2
InChIInChI=1S/C12H15NO/c1-9(14)13(2)12-7-6-10-4-3-5-11(10)8-12/h6-8H,3-5H2,1-2H3
InChIKeyZGWHYFRPDPAJFY-UHFFFAOYSA-N
XLogP2.16
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 52.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1H-inden-5-yl)-N-methylacetamide?
The IUPAC name of N-(2,3-dihydro-1H-inden-5-yl)-N-methylacetamide (CID 115190982) is N-(2,3-dihydro-1H-inden-5-yl)-N-methylacetamide.
What is the SMILES notation for N-(2,3-dihydro-1H-inden-5-yl)-N-methylacetamide?
The canonical SMILES for N-(2,3-dihydro-1H-inden-5-yl)-N-methylacetamide is CC(=O)N(C)c1ccc2c(c1)CCC2.
What is the InChIKey of N-(2,3-dihydro-1H-inden-5-yl)-N-methylacetamide?
The InChIKey is ZGWHYFRPDPAJFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO/c1-9(14)13(2)12-7-6-10-4-3-5-11(10)8-12/h6-8H,3-5H2,1-2H3.
What are the key properties of N-(2,3-dihydro-1H-inden-5-yl)-N-methylacetamide?
N-(2,3-dihydro-1H-inden-5-yl)-N-methylacetamide has a molecular weight of 189.26 g/mol, XLogP of 2.16, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1H-inden-5-yl)-N-methylacetamide is sourced from PubChem (CID 115190982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).