benzene;N-(3,4-dihydronaphthalen-1-yl)acetamide

C18H19NO — CID 159354733

IUPACbenzene;N-(3,4-dihydronaphthalen-1-yl)acetamide
SMILESCC(=O)NC1=CCCc2ccccc21.c1ccccc1
InChIInChI=1S/C12H13NO.C6H6/c1-9(14)13-12-8-4-6-10-5-2-3-7-11(10)12;1-2-4-6-5-3-1/h2-3,5,7-8H,4,6H2,1H3,(H,13,14);1-6H
InChIKeyLHTXYSZKBBUSBE-UHFFFAOYSA-N
MW265.36 g/mol
LogP3.80
Rot. Bonds1

About benzene;N-(3,4-dihydronaphthalen-1-yl)acetamide

benzene;N-(3,4-dihydronaphthalen-1-yl)acetamide (PubChem CID 159354733) has the molecular formula C18H19NO and a molecular weight of 265.36 g/mol. Its IUPAC name is benzene;N-(3,4-dihydronaphthalen-1-yl)acetamide.

Molecular Properties

Compound Namebenzene;N-(3,4-dihydronaphthalen-1-yl)acetamide
PubChem CID159354733
Molecular FormulaC18H19NO
Molecular Weight265.36 g/mol
Exact Mass265.15
IUPAC Namebenzene;N-(3,4-dihydronaphthalen-1-yl)acetamide
SMILESCC(=O)NC1=CCCc2ccccc21.c1ccccc1
InChIInChI=1S/C12H13NO.C6H6/c1-9(14)13-12-8-4-6-10-5-2-3-7-11(10)12;1-2-4-6-5-3-1/h2-3,5,7-8H,4,6H2,1H3,(H,13,14);1-6H
InChIKeyLHTXYSZKBBUSBE-UHFFFAOYSA-N
XLogP3.80
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of benzene;N-(3,4-dihydronaphthalen-1-yl)acetamide?
The IUPAC name of benzene;N-(3,4-dihydronaphthalen-1-yl)acetamide (CID 159354733) is benzene;N-(3,4-dihydronaphthalen-1-yl)acetamide.
What is the SMILES notation for benzene;N-(3,4-dihydronaphthalen-1-yl)acetamide?
The canonical SMILES for benzene;N-(3,4-dihydronaphthalen-1-yl)acetamide is CC(=O)NC1=CCCc2ccccc21.c1ccccc1.
What is the InChIKey of benzene;N-(3,4-dihydronaphthalen-1-yl)acetamide?
The InChIKey is LHTXYSZKBBUSBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NO.C6H6/c1-9(14)13-12-8-4-6-10-5-2-3-7-11(10)12;1-2-4-6-5-3-1/h2-3,5,7-8H,4,6H2,1H3,(H,13,14);1-6H.
What are the key properties of benzene;N-(3,4-dihydronaphthalen-1-yl)acetamide?
benzene;N-(3,4-dihydronaphthalen-1-yl)acetamide has a molecular weight of 265.36 g/mol, XLogP of 3.80, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for benzene;N-(3,4-dihydronaphthalen-1-yl)acetamide is sourced from PubChem (CID 159354733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).