N-(8-azabicyclo[3.2.1]octan-3-yl)cyclooctanecarboxamide

C16H28N2O — CID 65023449

IUPACN-(8-azabicyclo[3.2.1]octan-3-yl)cyclooctanecarboxamide
SMILESO=C(NC1CC2CCC(C1)N2)C1CCCCCCC1
InChIInChI=1S/C16H28N2O/c19-16(12-6-4-2-1-3-5-7-12)18-15-10-13-8-9-14(11-15)17-13/h12-15,17H,1-11H2,(H,18,19)
InChIKeyXFYRSSDDBGCTKL-UHFFFAOYSA-N
MW264.41 g/mol
LogP2.75
Rot. Bonds2

About N-(8-azabicyclo[3.2.1]octan-3-yl)cyclooctanecarboxamide

N-(8-azabicyclo[3.2.1]octan-3-yl)cyclooctanecarboxamide (PubChem CID 65023449) has the molecular formula C16H28N2O and a molecular weight of 264.41 g/mol. Its IUPAC name is N-(8-azabicyclo[3.2.1]octan-3-yl)cyclooctanecarboxamide.

Molecular Properties

Compound NameN-(8-azabicyclo[3.2.1]octan-3-yl)cyclooctanecarboxamide
PubChem CID65023449
Molecular FormulaC16H28N2O
Molecular Weight264.41 g/mol
Exact Mass264.22
IUPAC NameN-(8-azabicyclo[3.2.1]octan-3-yl)cyclooctanecarboxamide
SMILESO=C(NC1CC2CCC(C1)N2)C1CCCCCCC1
InChIInChI=1S/C16H28N2O/c19-16(12-6-4-2-1-3-5-7-12)18-15-10-13-8-9-14(11-15)17-13/h12-15,17H,1-11H2,(H,18,19)
InChIKeyXFYRSSDDBGCTKL-UHFFFAOYSA-N
XLogP2.75
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.41
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 3412875
N-cyclodecylcyclododecanecarboxamide
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N-(3-aminocyclobutyl)cyclooctanecarboxamide
CID 65023112
1-[(1S,5R)-9-azabicyclo[3.3.1]nonan-3-yl]-3-cyclohexylurea
CID 25415305
N-cyclopentylcyclobutanecarboxamide
CID 21158774
1-N,4-N-dicyclohexylcyclohexane-1,4-dicarboxamide
CID 2982201
N-piperidin-4-ylcycloheptanecarboxamide
CID 62587546
N-(8-azabicyclo[3.2.1]octan-3-yl)adamantane-2-carboxamide
CID 81099772
N-(5-cycloheptylcyclooctyl)cycloheptanecarboxamide
CID 166761294
N-(8-azabicyclo[3.2.1]octan-3-yl)-1-methyl-5-oxopyrrolidine-3-carboxamide
CID 119457640

Frequently Asked Questions

What is the IUPAC name of N-(8-azabicyclo[3.2.1]octan-3-yl)cyclooctanecarboxamide?
The IUPAC name of N-(8-azabicyclo[3.2.1]octan-3-yl)cyclooctanecarboxamide (CID 65023449) is N-(8-azabicyclo[3.2.1]octan-3-yl)cyclooctanecarboxamide.
What is the SMILES notation for N-(8-azabicyclo[3.2.1]octan-3-yl)cyclooctanecarboxamide?
The canonical SMILES for N-(8-azabicyclo[3.2.1]octan-3-yl)cyclooctanecarboxamide is O=C(NC1CC2CCC(C1)N2)C1CCCCCCC1.
What is the InChIKey of N-(8-azabicyclo[3.2.1]octan-3-yl)cyclooctanecarboxamide?
The InChIKey is XFYRSSDDBGCTKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O/c19-16(12-6-4-2-1-3-5-7-12)18-15-10-13-8-9-14(11-15)17-13/h12-15,17H,1-11H2,(H,18,19).
What are the key properties of N-(8-azabicyclo[3.2.1]octan-3-yl)cyclooctanecarboxamide?
N-(8-azabicyclo[3.2.1]octan-3-yl)cyclooctanecarboxamide has a molecular weight of 264.41 g/mol, XLogP of 2.75, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(8-azabicyclo[3.2.1]octan-3-yl)cyclooctanecarboxamide is sourced from PubChem (CID 65023449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).