N-(3,4-dihydronaphthalen-2-yl)propanamide

C13H15NO — CID 66810474

IUPACN-(3,4-dihydronaphthalen-2-yl)propanamide
SMILESCCC(=O)NC1=Cc2ccccc2CC1
InChIInChI=1S/C13H15NO/c1-2-13(15)14-12-8-7-10-5-3-4-6-11(10)9-12/h3-6,9H,2,7-8H2,1H3,(H,14,15)
InChIKeyQCXBZGVUOMUJPG-UHFFFAOYSA-N
MW201.27 g/mol
LogP2.50
Rot. Bonds2

About N-(3,4-dihydronaphthalen-2-yl)propanamide

N-(3,4-dihydronaphthalen-2-yl)propanamide (PubChem CID 66810474) has the molecular formula C13H15NO and a molecular weight of 201.27 g/mol. Its IUPAC name is N-(3,4-dihydronaphthalen-2-yl)propanamide.

Molecular Properties

Compound NameN-(3,4-dihydronaphthalen-2-yl)propanamide
PubChem CID66810474
Molecular FormulaC13H15NO
Molecular Weight201.27 g/mol
Exact Mass201.12
IUPAC NameN-(3,4-dihydronaphthalen-2-yl)propanamide
SMILESCCC(=O)NC1=Cc2ccccc2CC1
InChIInChI=1S/C13H15NO/c1-2-13(15)14-12-8-7-10-5-3-4-6-11(10)9-12/h3-6,9H,2,7-8H2,1H3,(H,14,15)
InChIKeyQCXBZGVUOMUJPG-UHFFFAOYSA-N
XLogP2.50
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(3,4-dihydronaphthalen-2-yl)propanamide?
The IUPAC name of N-(3,4-dihydronaphthalen-2-yl)propanamide (CID 66810474) is N-(3,4-dihydronaphthalen-2-yl)propanamide.
What is the SMILES notation for N-(3,4-dihydronaphthalen-2-yl)propanamide?
The canonical SMILES for N-(3,4-dihydronaphthalen-2-yl)propanamide is CCC(=O)NC1=Cc2ccccc2CC1.
What is the InChIKey of N-(3,4-dihydronaphthalen-2-yl)propanamide?
The InChIKey is QCXBZGVUOMUJPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO/c1-2-13(15)14-12-8-7-10-5-3-4-6-11(10)9-12/h3-6,9H,2,7-8H2,1H3,(H,14,15).
What are the key properties of N-(3,4-dihydronaphthalen-2-yl)propanamide?
N-(3,4-dihydronaphthalen-2-yl)propanamide has a molecular weight of 201.27 g/mol, XLogP of 2.50, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dihydronaphthalen-2-yl)propanamide is sourced from PubChem (CID 66810474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).