bicyclo[3.2.1]octane-1-carboxamide

C9H15NO — CID 57255847

IUPACbicyclo[3.2.1]octane-1-carboxamide
SMILESNC(=O)C12CCCC(CC1)C2
InChIInChI=1S/C9H15NO/c10-8(11)9-4-1-2-7(6-9)3-5-9/h7H,1-6H2,(H2,10,11)
InChIKeyFHYYOCLXSYOLBN-UHFFFAOYSA-N
MW153.22 g/mol
LogP1.44
Rot. Bonds1

About bicyclo[3.2.1]octane-1-carboxamide

bicyclo[3.2.1]octane-1-carboxamide (PubChem CID 57255847) has the molecular formula C9H15NO and a molecular weight of 153.22 g/mol. Its IUPAC name is bicyclo[3.2.1]octane-1-carboxamide.

Molecular Properties

Compound Namebicyclo[3.2.1]octane-1-carboxamide
PubChem CID57255847
Molecular FormulaC9H15NO
Molecular Weight153.22 g/mol
Exact Mass153.12
IUPAC Namebicyclo[3.2.1]octane-1-carboxamide
SMILESNC(=O)C12CCCC(CC1)C2
InChIInChI=1S/C9H15NO/c10-8(11)9-4-1-2-7(6-9)3-5-9/h7H,1-6H2,(H2,10,11)
InChIKeyFHYYOCLXSYOLBN-UHFFFAOYSA-N
XLogP1.44
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.22
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of bicyclo[3.2.1]octane-1-carboxamide?
The IUPAC name of bicyclo[3.2.1]octane-1-carboxamide (CID 57255847) is bicyclo[3.2.1]octane-1-carboxamide.
What is the SMILES notation for bicyclo[3.2.1]octane-1-carboxamide?
The canonical SMILES for bicyclo[3.2.1]octane-1-carboxamide is NC(=O)C12CCCC(CC1)C2.
What is the InChIKey of bicyclo[3.2.1]octane-1-carboxamide?
The InChIKey is FHYYOCLXSYOLBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO/c10-8(11)9-4-1-2-7(6-9)3-5-9/h7H,1-6H2,(H2,10,11).
What are the key properties of bicyclo[3.2.1]octane-1-carboxamide?
bicyclo[3.2.1]octane-1-carboxamide has a molecular weight of 153.22 g/mol, XLogP of 1.44, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for bicyclo[3.2.1]octane-1-carboxamide is sourced from PubChem (CID 57255847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).