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

C12H15NO — CID 12969384

IUPACN-(2,3-dihydro-1H-inden-1-yl)propanamide
SMILESCCC(=O)NC1CCc2ccccc21
InChIInChI=1S/C12H15NO/c1-2-12(14)13-11-8-7-9-5-3-4-6-10(9)11/h3-6,11H,2,7-8H2,1H3,(H,13,14)
InChIKeyRZBLQFKQMMGHSQ-UHFFFAOYSA-N
MW189.26 g/mol
LogP2.20
Rot. Bonds2

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

N-(2,3-dihydro-1H-inden-1-yl)propanamide (PubChem CID 12969384) has the molecular formula C12H15NO and a molecular weight of 189.26 g/mol. Its IUPAC name is N-(2,3-dihydro-1H-inden-1-yl)propanamide.

Molecular Properties

Compound NameN-(2,3-dihydro-1H-inden-1-yl)propanamide
PubChem CID12969384
Molecular FormulaC12H15NO
Molecular Weight189.26 g/mol
Exact Mass189.12
IUPAC NameN-(2,3-dihydro-1H-inden-1-yl)propanamide
SMILESCCC(=O)NC1CCc2ccccc21
InChIInChI=1S/C12H15NO/c1-2-12(14)13-11-8-7-9-5-3-4-6-10(9)11/h3-6,11H,2,7-8H2,1H3,(H,13,14)
InChIKeyRZBLQFKQMMGHSQ-UHFFFAOYSA-N
XLogP2.20
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1H-inden-1-yl)propanamide?
The IUPAC name of N-(2,3-dihydro-1H-inden-1-yl)propanamide (CID 12969384) is N-(2,3-dihydro-1H-inden-1-yl)propanamide.
What is the SMILES notation for N-(2,3-dihydro-1H-inden-1-yl)propanamide?
The canonical SMILES for N-(2,3-dihydro-1H-inden-1-yl)propanamide is CCC(=O)NC1CCc2ccccc21.
What is the InChIKey of N-(2,3-dihydro-1H-inden-1-yl)propanamide?
The InChIKey is RZBLQFKQMMGHSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO/c1-2-12(14)13-11-8-7-9-5-3-4-6-10(9)11/h3-6,11H,2,7-8H2,1H3,(H,13,14).
What are the key properties of N-(2,3-dihydro-1H-inden-1-yl)propanamide?
N-(2,3-dihydro-1H-inden-1-yl)propanamide has a molecular weight of 189.26 g/mol, XLogP of 2.20, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1H-inden-1-yl)propanamide is sourced from PubChem (CID 12969384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).