2-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)-N-methylacetamide

C15H21NO — CID 82082245

IUPAC2-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)-N-methylacetamide
SMILESCNC(=O)CC1CCC(C)(C)c2ccccc21
InChIInChI=1S/C15H21NO/c1-15(2)9-8-11(10-14(17)16-3)12-6-4-5-7-13(12)15/h4-7,11H,8-10H2,1-3H3,(H,16,17)
InChIKeyYMMUKHFUCHLZOL-UHFFFAOYSA-N
MW231.34 g/mol
LogP2.98
Rot. Bonds2

About 2-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)-N-methylacetamide

2-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)-N-methylacetamide (PubChem CID 82082245) has the molecular formula C15H21NO and a molecular weight of 231.34 g/mol. Its IUPAC name is 2-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)-N-methylacetamide.

Molecular Properties

Compound Name2-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)-N-methylacetamide
PubChem CID82082245
Molecular FormulaC15H21NO
Molecular Weight231.34 g/mol
Exact Mass231.16
IUPAC Name2-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)-N-methylacetamide
SMILESCNC(=O)CC1CCC(C)(C)c2ccccc21
InChIInChI=1S/C15H21NO/c1-15(2)9-8-11(10-14(17)16-3)12-6-4-5-7-13(12)15/h4-7,11H,8-10H2,1-3H3,(H,16,17)
InChIKeyYMMUKHFUCHLZOL-UHFFFAOYSA-N
XLogP2.98
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.34
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(3,3-dimethyl-1,2-dihydroinden-1-yl)-N-methylacetamide
CID 82079114
N-(5-tert-butyl-2-methylphenyl)sulfonyl-2-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)acetamide
CID 166322938
2-[(1R)-4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl]-N-pyrazin-2-ylsulfonylacetamide
CID 99696765
(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)methanamine
CID 43316841
2-(cyclopropylmethylamino)-N-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)acetamide;hydrochloride
CID 119758390
N-methyl-2-[1'-[(5-methylfuran-2-yl)methyl]spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide
CID 131643762
N,4,4-trimethyl-2,3-dihydro-1H-naphthalen-1-amine
CID 43147302
potassium 2-[(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)methylcarbamoylamino]-2-methylpropanoate
CID 167844586
1-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)butan-1-one
CID 83047721
N-methyl-2-[1'-(2-methylpropylsulfonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide
CID 131658314
2-[(1S)-1'-[(4-fluorophenyl)methyl]spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]-N-methylacetamide
CID 97375716
N-methyl-2-[1'-(thiophen-2-ylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide
CID 131657425

Frequently Asked Questions

What is the IUPAC name of 2-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)-N-methylacetamide?
The IUPAC name of 2-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)-N-methylacetamide (CID 82082245) is 2-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)-N-methylacetamide.
What is the SMILES notation for 2-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)-N-methylacetamide?
The canonical SMILES for 2-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)-N-methylacetamide is CNC(=O)CC1CCC(C)(C)c2ccccc21.
What is the InChIKey of 2-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)-N-methylacetamide?
The InChIKey is YMMUKHFUCHLZOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO/c1-15(2)9-8-11(10-14(17)16-3)12-6-4-5-7-13(12)15/h4-7,11H,8-10H2,1-3H3,(H,16,17).
What are the key properties of 2-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)-N-methylacetamide?
2-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)-N-methylacetamide has a molecular weight of 231.34 g/mol, XLogP of 2.98, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)-N-methylacetamide is sourced from PubChem (CID 82082245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).