N-(1-azabicyclo[3.3.1]nonan-4-yl)propanamide

C11H20N2O — CID 130934342

IUPACN-(1-azabicyclo[3.3.1]nonan-4-yl)propanamide
SMILESCCC(=O)NC1CCN2CCCC1C2
InChIInChI=1S/C11H20N2O/c1-2-11(14)12-10-5-7-13-6-3-4-9(10)8-13/h9-10H,2-8H2,1H3,(H,12,14)
InChIKeyFHFDFKIEJUKCDW-UHFFFAOYSA-N
MW196.29 g/mol
LogP1.00
Rot. Bonds2

About N-(1-azabicyclo[3.3.1]nonan-4-yl)propanamide

N-(1-azabicyclo[3.3.1]nonan-4-yl)propanamide (PubChem CID 130934342) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is N-(1-azabicyclo[3.3.1]nonan-4-yl)propanamide.

Molecular Properties

Compound NameN-(1-azabicyclo[3.3.1]nonan-4-yl)propanamide
PubChem CID130934342
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC NameN-(1-azabicyclo[3.3.1]nonan-4-yl)propanamide
SMILESCCC(=O)NC1CCN2CCCC1C2
InChIInChI=1S/C11H20N2O/c1-2-11(14)12-10-5-7-13-6-3-4-9(10)8-13/h9-10H,2-8H2,1H3,(H,12,14)
InChIKeyFHFDFKIEJUKCDW-UHFFFAOYSA-N
XLogP1.00
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-(1-azabicyclo[3.2.1]octan-4-ylamino)phenyl]propanamide
CID 105364117
N-propan-2-yl-1-azabicyclo[3.3.1]nonan-4-amine
CID 83817171
benzyl N-(1-azabicyclo[3.3.1]nonan-4-yl)carbamate
CID 130993442
N-[(1S,9aS)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]propanamide
CID 71665848
2-(1-azabicyclo[3.2.1]octan-4-ylamino)-N-propylacetamide
CID 105363868
N-[(3S)-1-[2-[(3S)-3-(propanoylamino)piperidin-1-yl]ethyl]piperidin-3-yl]propanamide
CID 96549596
N-(1-azabicyclo[2.2.2]octan-3-yl)-2-(cyclopropylamino)acetamide
CID 60687389
N-[(6S,7R,8R)-1,7,8-trihydroxy-1,2,3,5,6,7,8,8a-octahydroindolizin-6-yl]propanamide
CID 138727871
N-(2-aminocyclohexyl)propanamide
CID 61036997
N-[(1R,2S,4R)-2-bicyclo[2.2.1]heptanyl]propanamide
CID 98230994
2-(1-azabicyclo[3.2.1]octan-4-ylamino)acetamide
CID 105363555
2-(1-azabicyclo[3.2.1]octan-4-ylamino)-N-propylpropanamide
CID 105363972

Frequently Asked Questions

What is the IUPAC name of N-(1-azabicyclo[3.3.1]nonan-4-yl)propanamide?
The IUPAC name of N-(1-azabicyclo[3.3.1]nonan-4-yl)propanamide (CID 130934342) is N-(1-azabicyclo[3.3.1]nonan-4-yl)propanamide.
What is the SMILES notation for N-(1-azabicyclo[3.3.1]nonan-4-yl)propanamide?
The canonical SMILES for N-(1-azabicyclo[3.3.1]nonan-4-yl)propanamide is CCC(=O)NC1CCN2CCCC1C2.
What is the InChIKey of N-(1-azabicyclo[3.3.1]nonan-4-yl)propanamide?
The InChIKey is FHFDFKIEJUKCDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O/c1-2-11(14)12-10-5-7-13-6-3-4-9(10)8-13/h9-10H,2-8H2,1H3,(H,12,14).
What are the key properties of N-(1-azabicyclo[3.3.1]nonan-4-yl)propanamide?
N-(1-azabicyclo[3.3.1]nonan-4-yl)propanamide has a molecular weight of 196.29 g/mol, XLogP of 1.00, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-azabicyclo[3.3.1]nonan-4-yl)propanamide is sourced from PubChem (CID 130934342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).