N-cyclooctyl-2-methoxy-2-phenylacetamide

C17H25NO2 — CID 2921709

IUPACN-cyclooctyl-2-methoxy-2-phenylacetamide
SMILESCOC(C(=O)NC1CCCCCCC1)c1ccccc1
InChIInChI=1S/C17H25NO2/c1-20-16(14-10-6-5-7-11-14)17(19)18-15-12-8-3-2-4-9-13-15/h5-7,10-11,15-16H,2-4,8-9,12-13H2,1H3,(H,18,19)
InChIKeyIMVFDJZXHBDORJ-UHFFFAOYSA-N
MW275.39 g/mol
LogP3.60
Rot. Bonds4

About N-cyclooctyl-2-methoxy-2-phenylacetamide

N-cyclooctyl-2-methoxy-2-phenylacetamide (PubChem CID 2921709) has the molecular formula C17H25NO2 and a molecular weight of 275.39 g/mol. Its IUPAC name is N-cyclooctyl-2-methoxy-2-phenylacetamide.

Molecular Properties

Compound NameN-cyclooctyl-2-methoxy-2-phenylacetamide
PubChem CID2921709
Molecular FormulaC17H25NO2
Molecular Weight275.39 g/mol
Exact Mass275.19
IUPAC NameN-cyclooctyl-2-methoxy-2-phenylacetamide
SMILESCOC(C(=O)NC1CCCCCCC1)c1ccccc1
InChIInChI=1S/C17H25NO2/c1-20-16(14-10-6-5-7-11-14)17(19)18-15-12-8-3-2-4-9-13-15/h5-7,10-11,15-16H,2-4,8-9,12-13H2,1H3,(H,18,19)
InChIKeyIMVFDJZXHBDORJ-UHFFFAOYSA-N
XLogP3.60
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.39
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclooctyl-2-methoxy-2-phenylacetamide?
The IUPAC name of N-cyclooctyl-2-methoxy-2-phenylacetamide (CID 2921709) is N-cyclooctyl-2-methoxy-2-phenylacetamide.
What is the SMILES notation for N-cyclooctyl-2-methoxy-2-phenylacetamide?
The canonical SMILES for N-cyclooctyl-2-methoxy-2-phenylacetamide is COC(C(=O)NC1CCCCCCC1)c1ccccc1.
What is the InChIKey of N-cyclooctyl-2-methoxy-2-phenylacetamide?
The InChIKey is IMVFDJZXHBDORJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO2/c1-20-16(14-10-6-5-7-11-14)17(19)18-15-12-8-3-2-4-9-13-15/h5-7,10-11,15-16H,2-4,8-9,12-13H2,1H3,(H,18,19).
What are the key properties of N-cyclooctyl-2-methoxy-2-phenylacetamide?
N-cyclooctyl-2-methoxy-2-phenylacetamide has a molecular weight of 275.39 g/mol, XLogP of 3.60, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclooctyl-2-methoxy-2-phenylacetamide is sourced from PubChem (CID 2921709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).