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

C11H20N2O — CID 61233297

IUPACN-(8-azabicyclo[3.2.1]octan-3-yl)butanamide
SMILESCCCC(=O)NC1CC2CCC(C1)N2
InChIInChI=1S/C11H20N2O/c1-2-3-11(14)13-10-6-8-4-5-9(7-10)12-8/h8-10,12H,2-7H2,1H3,(H,13,14)
InChIKeyXWJAYKCVQHOFCU-UHFFFAOYSA-N
MW196.29 g/mol
LogP1.19
Rot. Bonds3

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

N-(8-azabicyclo[3.2.1]octan-3-yl)butanamide (PubChem CID 61233297) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is N-(8-azabicyclo[3.2.1]octan-3-yl)butanamide.

Molecular Properties

Compound NameN-(8-azabicyclo[3.2.1]octan-3-yl)butanamide
PubChem CID61233297
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC NameN-(8-azabicyclo[3.2.1]octan-3-yl)butanamide
SMILESCCCC(=O)NC1CC2CCC(C1)N2
InChIInChI=1S/C11H20N2O/c1-2-3-11(14)13-10-6-8-4-5-9(7-10)12-8/h8-10,12H,2-7H2,1H3,(H,13,14)
InChIKeyXWJAYKCVQHOFCU-UHFFFAOYSA-N
XLogP1.19
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N'-(8-azabicyclo[3.2.1]octan-3-yl)-N-propylbutanediamide;hydrochloride
CID 119458518
N-(8-azabicyclo[3.2.1]octan-3-yl)-3-methoxypropanamide
CID 62589135
N-(8-azabicyclo[3.2.1]octan-3-yl)-2-propylsulfanylacetamide;hydrochloride
CID 119456893
N-(8-azabicyclo[3.2.1]octan-3-yl)hex-5-enamide
CID 119459100
N-(8-azabicyclo[3.2.1]octan-3-yl)-N'-propan-2-ylpentanediamide;hydrochloride
CID 119456671
N-(8-azabicyclo[3.2.1]octan-3-yl)-3-(4-ethylphenyl)propanamide;hydrochloride
CID 119457019
N-(8-azabicyclo[3.2.1]octan-3-yl)-3,3-dimethylbutanamide;hydrochloride
CID 119455659
N-(8-azabicyclo[3.2.1]octan-3-yl)-3-methylbutanamide;hydrochloride
CID 119457462
N-(8-azabicyclo[3.2.1]octan-3-yl)-2-(3-methylcyclopentyl)acetamide
CID 119457969
N-(8-azabicyclo[3.2.1]octan-3-yl)-3-(2,2,2-trifluoroethoxy)propanamide
CID 103805909
N-(8-azabicyclo[3.2.1]octan-3-yl)-3-ethylheptanamide;hydrochloride
CID 119456810
N-(8-azabicyclo[3.2.1]octan-3-yl)-3,4-dimethylpentanamide;hydrochloride
CID 119459568

Frequently Asked Questions

What is the IUPAC name of N-(8-azabicyclo[3.2.1]octan-3-yl)butanamide?
The IUPAC name of N-(8-azabicyclo[3.2.1]octan-3-yl)butanamide (CID 61233297) is N-(8-azabicyclo[3.2.1]octan-3-yl)butanamide.
What is the SMILES notation for N-(8-azabicyclo[3.2.1]octan-3-yl)butanamide?
The canonical SMILES for N-(8-azabicyclo[3.2.1]octan-3-yl)butanamide is CCCC(=O)NC1CC2CCC(C1)N2.
What is the InChIKey of N-(8-azabicyclo[3.2.1]octan-3-yl)butanamide?
The InChIKey is XWJAYKCVQHOFCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O/c1-2-3-11(14)13-10-6-8-4-5-9(7-10)12-8/h8-10,12H,2-7H2,1H3,(H,13,14).
What are the key properties of N-(8-azabicyclo[3.2.1]octan-3-yl)butanamide?
N-(8-azabicyclo[3.2.1]octan-3-yl)butanamide has a molecular weight of 196.29 g/mol, XLogP of 1.19, 3 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)butanamide is sourced from PubChem (CID 61233297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).