N-(2-hydroxy-1-naphthalen-1-ylethyl)-N-methylacetamide

C15H17NO2 — CID 116860926

IUPACN-(2-hydroxy-1-naphthalen-1-ylethyl)-N-methylacetamide
SMILESCC(=O)N(C)C(CO)c1cccc2ccccc12
InChIInChI=1S/C15H17NO2/c1-11(18)16(2)15(10-17)14-9-5-7-12-6-3-4-8-13(12)14/h3-9,15,17H,10H2,1-2H3
InChIKeyVXXKUDANZHFKIU-UHFFFAOYSA-N
MW243.31 g/mol
LogP2.35
Rot. Bonds3

About N-(2-hydroxy-1-naphthalen-1-ylethyl)-N-methylacetamide

N-(2-hydroxy-1-naphthalen-1-ylethyl)-N-methylacetamide (PubChem CID 116860926) has the molecular formula C15H17NO2 and a molecular weight of 243.31 g/mol. Its IUPAC name is N-(2-hydroxy-1-naphthalen-1-ylethyl)-N-methylacetamide.

Molecular Properties

Compound NameN-(2-hydroxy-1-naphthalen-1-ylethyl)-N-methylacetamide
PubChem CID116860926
Molecular FormulaC15H17NO2
Molecular Weight243.31 g/mol
Exact Mass243.13
IUPAC NameN-(2-hydroxy-1-naphthalen-1-ylethyl)-N-methylacetamide
SMILESCC(=O)N(C)C(CO)c1cccc2ccccc12
InChIInChI=1S/C15H17NO2/c1-11(18)16(2)15(10-17)14-9-5-7-12-6-3-4-8-13(12)14/h3-9,15,17H,10H2,1-2H3
InChIKeyVXXKUDANZHFKIU-UHFFFAOYSA-N
XLogP2.35
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(2,5-dimethoxyphenyl)-2-hydroxyethyl]-N-methylacetamide
CID 116860821
2-[2-(dimethylamino)-2-naphthalen-1-ylethyl]sulfonyl-N,N-dimethyl-1-naphthalen-1-ylethanamine
CID 141080662
N-[(2R)-2-(dimethylamino)-2-naphthalen-1-ylethyl]naphthalene-1-carboxamide
CID 8701456
3-methyl-2-naphthalen-1-ylbut-3-en-1-ol
CID 10632339
N,N',2-trimethyl-N'-[(2S)-2-naphthalen-1-ylpropanoyl]propanehydrazide
CID 27877300
3,3,3-trideuterio-2-naphthalen-1-ylpropan-1-ol
CID 169444620
1-methyl-1-[(1R)-1-naphthalen-1-ylethyl]-3-[(1S)-1-naphthalen-1-ylethyl]urea
CID 101424575
N,N'-bis(2-hydroxy-1-naphthalen-1-ylethyl)oxamide
CID 23140892
[(1R)-1-naphthalen-1-ylethyl] acetate
CID 13082477
1-(dimethylamino)-2-methyl-1-naphthalen-1-ylpropan-2-ol
CID 116911415
N,N-diethyl-2-naphthalen-1-ylpropanamide
CID 15100949
1,1,1-trifluoro-3-naphthalen-1-ylpentane-2,4-dione
CID 174295450

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-1-naphthalen-1-ylethyl)-N-methylacetamide?
The IUPAC name of N-(2-hydroxy-1-naphthalen-1-ylethyl)-N-methylacetamide (CID 116860926) is N-(2-hydroxy-1-naphthalen-1-ylethyl)-N-methylacetamide.
What is the SMILES notation for N-(2-hydroxy-1-naphthalen-1-ylethyl)-N-methylacetamide?
The canonical SMILES for N-(2-hydroxy-1-naphthalen-1-ylethyl)-N-methylacetamide is CC(=O)N(C)C(CO)c1cccc2ccccc12.
What is the InChIKey of N-(2-hydroxy-1-naphthalen-1-ylethyl)-N-methylacetamide?
The InChIKey is VXXKUDANZHFKIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO2/c1-11(18)16(2)15(10-17)14-9-5-7-12-6-3-4-8-13(12)14/h3-9,15,17H,10H2,1-2H3.
What are the key properties of N-(2-hydroxy-1-naphthalen-1-ylethyl)-N-methylacetamide?
N-(2-hydroxy-1-naphthalen-1-ylethyl)-N-methylacetamide has a molecular weight of 243.31 g/mol, XLogP of 2.35, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-1-naphthalen-1-ylethyl)-N-methylacetamide is sourced from PubChem (CID 116860926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).