N-[(1R,2R)-2-hydroxycyclohexyl]-2-naphthalen-2-ylacetamide

C18H21NO2 — CID 104927093

IUPACN-[(1R,2R)-2-hydroxycyclohexyl]-2-naphthalen-2-ylacetamide
SMILESO=C(Cc1ccc2ccccc2c1)N[C@@H]1CCCC[C@H]1O
InChIInChI=1S/C18H21NO2/c20-17-8-4-3-7-16(17)19-18(21)12-13-9-10-14-5-1-2-6-15(14)11-13/h1-2,5-6,9-11,16-17,20H,3-4,7-8,12H2,(H,19,21)/t16-,17-/m1/s1
InChIKeyQXVWGIROXOAPSV-IAGOWNOFSA-N
MW283.37 g/mol
LogP2.80
Rot. Bonds3

About N-[(1R,2R)-2-hydroxycyclohexyl]-2-naphthalen-2-ylacetamide

N-[(1R,2R)-2-hydroxycyclohexyl]-2-naphthalen-2-ylacetamide (PubChem CID 104927093) has the molecular formula C18H21NO2 and a molecular weight of 283.37 g/mol. Its IUPAC name is N-[(1R,2R)-2-hydroxycyclohexyl]-2-naphthalen-2-ylacetamide.

Molecular Properties

Compound NameN-[(1R,2R)-2-hydroxycyclohexyl]-2-naphthalen-2-ylacetamide
PubChem CID104927093
Molecular FormulaC18H21NO2
Molecular Weight283.37 g/mol
Exact Mass283.16
IUPAC NameN-[(1R,2R)-2-hydroxycyclohexyl]-2-naphthalen-2-ylacetamide
SMILESO=C(Cc1ccc2ccccc2c1)N[C@@H]1CCCC[C@H]1O
InChIInChI=1S/C18H21NO2/c20-17-8-4-3-7-16(17)19-18(21)12-13-9-10-14-5-1-2-6-15(14)11-13/h1-2,5-6,9-11,16-17,20H,3-4,7-8,12H2,(H,19,21)/t16-,17-/m1/s1
InChIKeyQXVWGIROXOAPSV-IAGOWNOFSA-N
XLogP2.80
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 52.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(aminomethyl)cyclopentyl]-2-naphthalen-2-ylacetamide;hydrochloride
CID 119600586
N-(2-hydroxycyclohexyl)-2-(4-hydroxyphenyl)acetamide
CID 62361084
2-(4-bromophenyl)-N-[(1S,2R)-2-hydroxycyclohexyl]acetamide
CID 94414749
N-cyclopentyl-3-hydroxy-2-[(2-naphthalen-2-ylacetyl)amino]propanamide
CID 3602543
N-[2-(aminomethyl)cyclohexyl]-3-naphthalen-2-ylpropanamide
CID 119611998
1-cyclooctyl-2-naphthalen-2-ylethanone
CID 65018574
2-naphthalen-2-yl-N-[(1S,5R,6S)-2-oxabicyclo[3.2.0]heptan-6-yl]acetamide
CID 91792975
2-naphthalen-2-yl-N-[(1R,5S,6R)-2-oxabicyclo[3.2.0]heptan-6-yl]acetamide
CID 133268711
2-phenyl-N-[(1S,2S)-2-[(2-phenylacetyl)amino]cyclohexyl]acetamide
CID 1011315
1-cycloheptyl-3-naphthalen-2-ylpropan-2-one
CID 114458055
N-(2-hydroxycyclohexyl)-2-[4-(trifluoromethyl)phenyl]acetamide
CID 62366302
N-(8-azabicyclo[3.2.1]octan-3-yl)-2-naphthalen-2-ylacetamide
CID 119455156

Frequently Asked Questions

What is the IUPAC name of N-[(1R,2R)-2-hydroxycyclohexyl]-2-naphthalen-2-ylacetamide?
The IUPAC name of N-[(1R,2R)-2-hydroxycyclohexyl]-2-naphthalen-2-ylacetamide (CID 104927093) is N-[(1R,2R)-2-hydroxycyclohexyl]-2-naphthalen-2-ylacetamide.
What is the SMILES notation for N-[(1R,2R)-2-hydroxycyclohexyl]-2-naphthalen-2-ylacetamide?
The canonical SMILES for N-[(1R,2R)-2-hydroxycyclohexyl]-2-naphthalen-2-ylacetamide is O=C(Cc1ccc2ccccc2c1)N[C@@H]1CCCC[C@H]1O.
What is the InChIKey of N-[(1R,2R)-2-hydroxycyclohexyl]-2-naphthalen-2-ylacetamide?
The InChIKey is QXVWGIROXOAPSV-IAGOWNOFSA-N. The full InChI is InChI=1S/C18H21NO2/c20-17-8-4-3-7-16(17)19-18(21)12-13-9-10-14-5-1-2-6-15(14)11-13/h1-2,5-6,9-11,16-17,20H,3-4,7-8,12H2,(H,19,21)/t16-,17-/m1/s1.
What are the key properties of N-[(1R,2R)-2-hydroxycyclohexyl]-2-naphthalen-2-ylacetamide?
N-[(1R,2R)-2-hydroxycyclohexyl]-2-naphthalen-2-ylacetamide has a molecular weight of 283.37 g/mol, XLogP of 2.80, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R,2R)-2-hydroxycyclohexyl]-2-naphthalen-2-ylacetamide is sourced from PubChem (CID 104927093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).