N-[(1R,2R)-2-(dimethylamino)cyclohexyl]-N-methyl-2-naphthalen-1-ylacetamide

C21H28N2O — CID 70604955

IUPACN-[(1R,2R)-2-(dimethylamino)cyclohexyl]-N-methyl-2-naphthalen-1-ylacetamide
SMILESCN(C)[C@@H]1CCCC[C@H]1N(C)C(=O)Cc1cccc2ccccc12
InChIInChI=1S/C21H28N2O/c1-22(2)19-13-6-7-14-20(19)23(3)21(24)15-17-11-8-10-16-9-4-5-12-18(16)17/h4-5,8-12,19-20H,6-7,13-15H2,1-3H3/t19-,20-/m1/s1
InChIKeyUDEYKPUXMMKHLW-WOJBJXKFSA-N
MW324.47 g/mol
LogP3.71
Rot. Bonds4

About N-[(1R,2R)-2-(dimethylamino)cyclohexyl]-N-methyl-2-naphthalen-1-ylacetamide

N-[(1R,2R)-2-(dimethylamino)cyclohexyl]-N-methyl-2-naphthalen-1-ylacetamide (PubChem CID 70604955) has the molecular formula C21H28N2O and a molecular weight of 324.47 g/mol. Its IUPAC name is N-[(1R,2R)-2-(dimethylamino)cyclohexyl]-N-methyl-2-naphthalen-1-ylacetamide.

Molecular Properties

Compound NameN-[(1R,2R)-2-(dimethylamino)cyclohexyl]-N-methyl-2-naphthalen-1-ylacetamide
PubChem CID70604955
Molecular FormulaC21H28N2O
Molecular Weight324.47 g/mol
Exact Mass324.22
IUPAC NameN-[(1R,2R)-2-(dimethylamino)cyclohexyl]-N-methyl-2-naphthalen-1-ylacetamide
SMILESCN(C)[C@@H]1CCCC[C@H]1N(C)C(=O)Cc1cccc2ccccc12
InChIInChI=1S/C21H28N2O/c1-22(2)19-13-6-7-14-20(19)23(3)21(24)15-17-11-8-10-16-9-4-5-12-18(16)17/h4-5,8-12,19-20H,6-7,13-15H2,1-3H3/t19-,20-/m1/s1
InChIKeyUDEYKPUXMMKHLW-WOJBJXKFSA-N
XLogP3.71
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.47
LogP ≤ 53.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-methoxyphenyl)-N-[2-[[2-(2-methoxyphenyl)acetyl]-methylamino]cyclohexyl]-N-methylacetamide
CID 71910234
N-[(1S)-2,3-dihydro-1H-inden-1-yl]-N-methyl-2-naphthalen-1-ylacetamide
CID 97184949
2-(3,4-dichlorophenyl)-N-[(1S,2R)-2-(dimethylamino)cyclohexyl]-N-methylacetamide
CID 169447588
2-(3,4-difluorophenyl)-N-[(1R,2R)-2-(dimethylamino)cyclohexyl]-N-methylacetamide
CID 165362286
N-(2-aminocyclohexyl)-N-methylnaphthalene-1-carboxamide
CID 102638977
N-(2-chlorocyclohexyl)-2-(2-fluorophenyl)-N-methylacetamide
CID 102638052
N-(2-aminoethyl)-N-cyclobutyl-2-naphthalen-1-ylacetamide
CID 102874058
N-methyl-2-naphthalen-1-yl-N-[(5S,6S)-6-pyrrolidin-1-yl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-yl]acetamide
CID 54362115
1-cyclopentyl-3-naphthalen-1-ylpropan-2-one
CID 61055471
2-(1-benzothiophen-4-yl)-N-methyl-N-[(1R,2R)-2-(methylamino)cyclohexyl]acetamide;hydrochloride
CID 18607203
2-bromo-N-methyl-N-(naphthalen-1-ylmethyl)cyclohexan-1-amine
CID 102637268
N-(2-chlorocyclohexyl)-2-(2,3-difluorophenyl)-N-methylacetamide
CID 102638196

Frequently Asked Questions

What is the IUPAC name of N-[(1R,2R)-2-(dimethylamino)cyclohexyl]-N-methyl-2-naphthalen-1-ylacetamide?
The IUPAC name of N-[(1R,2R)-2-(dimethylamino)cyclohexyl]-N-methyl-2-naphthalen-1-ylacetamide (CID 70604955) is N-[(1R,2R)-2-(dimethylamino)cyclohexyl]-N-methyl-2-naphthalen-1-ylacetamide.
What is the SMILES notation for N-[(1R,2R)-2-(dimethylamino)cyclohexyl]-N-methyl-2-naphthalen-1-ylacetamide?
The canonical SMILES for N-[(1R,2R)-2-(dimethylamino)cyclohexyl]-N-methyl-2-naphthalen-1-ylacetamide is CN(C)[C@@H]1CCCC[C@H]1N(C)C(=O)Cc1cccc2ccccc12.
What is the InChIKey of N-[(1R,2R)-2-(dimethylamino)cyclohexyl]-N-methyl-2-naphthalen-1-ylacetamide?
The InChIKey is UDEYKPUXMMKHLW-WOJBJXKFSA-N. The full InChI is InChI=1S/C21H28N2O/c1-22(2)19-13-6-7-14-20(19)23(3)21(24)15-17-11-8-10-16-9-4-5-12-18(16)17/h4-5,8-12,19-20H,6-7,13-15H2,1-3H3/t19-,20-/m1/s1.
What are the key properties of N-[(1R,2R)-2-(dimethylamino)cyclohexyl]-N-methyl-2-naphthalen-1-ylacetamide?
N-[(1R,2R)-2-(dimethylamino)cyclohexyl]-N-methyl-2-naphthalen-1-ylacetamide has a molecular weight of 324.47 g/mol, XLogP of 3.71, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R,2R)-2-(dimethylamino)cyclohexyl]-N-methyl-2-naphthalen-1-ylacetamide is sourced from PubChem (CID 70604955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).