N-(1,2-dihydroacenaphthylen-1-ylmethyl)acetamide

C15H15NO — CID 10704399

IUPACN-(1,2-dihydroacenaphthylen-1-ylmethyl)acetamide
SMILESCC(=O)NCC1Cc2cccc3cccc1c23
InChIInChI=1S/C15H15NO/c1-10(17)16-9-13-8-12-6-2-4-11-5-3-7-14(13)15(11)12/h2-7,13H,8-9H2,1H3,(H,16,17)
InChIKeyMWMUHSCVSNAERX-UHFFFAOYSA-N
MW225.29 g/mol
LogP2.62
Rot. Bonds2

About N-(1,2-dihydroacenaphthylen-1-ylmethyl)acetamide

N-(1,2-dihydroacenaphthylen-1-ylmethyl)acetamide (PubChem CID 10704399) has the molecular formula C15H15NO and a molecular weight of 225.29 g/mol. Its IUPAC name is N-(1,2-dihydroacenaphthylen-1-ylmethyl)acetamide.

Molecular Properties

Compound NameN-(1,2-dihydroacenaphthylen-1-ylmethyl)acetamide
PubChem CID10704399
Molecular FormulaC15H15NO
Molecular Weight225.29 g/mol
Exact Mass225.12
IUPAC NameN-(1,2-dihydroacenaphthylen-1-ylmethyl)acetamide
SMILESCC(=O)NCC1Cc2cccc3cccc1c23
InChIInChI=1S/C15H15NO/c1-10(17)16-9-13-8-12-6-2-4-11-5-3-7-14(13)15(11)12/h2-7,13H,8-9H2,1H3,(H,16,17)
InChIKeyMWMUHSCVSNAERX-UHFFFAOYSA-N
XLogP2.62
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(1,2-dihydroacenaphthylen-1-ylmethyl)acetamide?
The IUPAC name of N-(1,2-dihydroacenaphthylen-1-ylmethyl)acetamide (CID 10704399) is N-(1,2-dihydroacenaphthylen-1-ylmethyl)acetamide.
What is the SMILES notation for N-(1,2-dihydroacenaphthylen-1-ylmethyl)acetamide?
The canonical SMILES for N-(1,2-dihydroacenaphthylen-1-ylmethyl)acetamide is CC(=O)NCC1Cc2cccc3cccc1c23.
What is the InChIKey of N-(1,2-dihydroacenaphthylen-1-ylmethyl)acetamide?
The InChIKey is MWMUHSCVSNAERX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO/c1-10(17)16-9-13-8-12-6-2-4-11-5-3-7-14(13)15(11)12/h2-7,13H,8-9H2,1H3,(H,16,17).
What are the key properties of N-(1,2-dihydroacenaphthylen-1-ylmethyl)acetamide?
N-(1,2-dihydroacenaphthylen-1-ylmethyl)acetamide has a molecular weight of 225.29 g/mol, XLogP of 2.62, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,2-dihydroacenaphthylen-1-ylmethyl)acetamide is sourced from PubChem (CID 10704399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).