N-(4-hydroxycyclohexyl)-2-naphthalen-1-yloxyacetamide

C18H21NO3 — CID 112788976

IUPACN-(4-hydroxycyclohexyl)-2-naphthalen-1-yloxyacetamide
SMILESO=C(COc1cccc2ccccc12)NC1CCC(O)CC1
InChIInChI=1S/C18H21NO3/c20-15-10-8-14(9-11-15)19-18(21)12-22-17-7-3-5-13-4-1-2-6-16(13)17/h1-7,14-15,20H,8-12H2,(H,19,21)
InChIKeyIZWWBZOHAQWCNJ-UHFFFAOYSA-N
MW299.37 g/mol
LogP2.64
Rot. Bonds4

About N-(4-hydroxycyclohexyl)-2-naphthalen-1-yloxyacetamide

N-(4-hydroxycyclohexyl)-2-naphthalen-1-yloxyacetamide (PubChem CID 112788976) has the molecular formula C18H21NO3 and a molecular weight of 299.37 g/mol. Its IUPAC name is N-(4-hydroxycyclohexyl)-2-naphthalen-1-yloxyacetamide.

Molecular Properties

Compound NameN-(4-hydroxycyclohexyl)-2-naphthalen-1-yloxyacetamide
PubChem CID112788976
Molecular FormulaC18H21NO3
Molecular Weight299.37 g/mol
Exact Mass299.15
IUPAC NameN-(4-hydroxycyclohexyl)-2-naphthalen-1-yloxyacetamide
SMILESO=C(COc1cccc2ccccc12)NC1CCC(O)CC1
InChIInChI=1S/C18H21NO3/c20-15-10-8-14(9-11-15)19-18(21)12-22-17-7-3-5-13-4-1-2-6-16(13)17/h1-7,14-15,20H,8-12H2,(H,19,21)
InChIKeyIZWWBZOHAQWCNJ-UHFFFAOYSA-N
XLogP2.64
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.37
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

cis-(1R,3S)-3-[(2-naphthalen-1-yloxyacetyl)amino]cyclopentane-1-carboxylic acid
CID 120677762
cis-(1S,3R)-3-[(2-naphthalen-1-yloxyacetyl)amino]cyclopentane-1-carboxylic acid
CID 120675430
2-(2,3-dimethylphenoxy)-N-(4-hydroxycyclohexyl)acetamide
CID 43389110
2-naphthalen-1-yloxy-N-[2-[(2-naphthalen-1-yloxyacetyl)amino]cyclohexyl]acetamide
CID 5176839
2-naphthalen-1-yloxy-N-piperidin-3-ylacetamide;hydrochloride
CID 119426850
N-cyclopropyl-2-(2-hydroxyphenoxy)acetamide
CID 2687934
N-cyclopropyl-2-(2,3-dimethoxyphenoxy)acetamide
CID 112978329
N-(2-methylpiperidin-4-yl)-2-naphthalen-1-yloxyacetamide;hydrochloride
CID 120599567
N-[(1S,2R)-2-methylcyclohexyl]-2-naphthalen-1-yloxyacetamide
CID 2504510
N-[(1S)-1-cyclopropylethyl]-2-naphthalen-1-yloxyacetamide
CID 9014883
2-[1-(2-aminoethyl)naphthalen-2-yl]oxy-N-cyclopropylacetamide
CID 60906439
N-[(1S,2R,3R)-2,3-dimethylcyclohexyl]-2-naphthalen-1-yloxyacetamide
CID 11917810

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxycyclohexyl)-2-naphthalen-1-yloxyacetamide?
The IUPAC name of N-(4-hydroxycyclohexyl)-2-naphthalen-1-yloxyacetamide (CID 112788976) is N-(4-hydroxycyclohexyl)-2-naphthalen-1-yloxyacetamide.
What is the SMILES notation for N-(4-hydroxycyclohexyl)-2-naphthalen-1-yloxyacetamide?
The canonical SMILES for N-(4-hydroxycyclohexyl)-2-naphthalen-1-yloxyacetamide is O=C(COc1cccc2ccccc12)NC1CCC(O)CC1.
What is the InChIKey of N-(4-hydroxycyclohexyl)-2-naphthalen-1-yloxyacetamide?
The InChIKey is IZWWBZOHAQWCNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO3/c20-15-10-8-14(9-11-15)19-18(21)12-22-17-7-3-5-13-4-1-2-6-16(13)17/h1-7,14-15,20H,8-12H2,(H,19,21).
What are the key properties of N-(4-hydroxycyclohexyl)-2-naphthalen-1-yloxyacetamide?
N-(4-hydroxycyclohexyl)-2-naphthalen-1-yloxyacetamide has a molecular weight of 299.37 g/mol, XLogP of 2.64, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxycyclohexyl)-2-naphthalen-1-yloxyacetamide is sourced from PubChem (CID 112788976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).