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

C13H24N2O — CID 61232017

IUPACN-(8-azabicyclo[3.2.1]octan-3-yl)-N-methylpentanamide
SMILESCCCCC(=O)N(C)C1CC2CCC(C1)N2
InChIInChI=1S/C13H24N2O/c1-3-4-5-13(16)15(2)12-8-10-6-7-11(9-12)14-10/h10-12,14H,3-9H2,1-2H3
InChIKeyIVQOMTGGCGUZTO-UHFFFAOYSA-N
MW224.35 g/mol
LogP1.92
Rot. Bonds4

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

N-(8-azabicyclo[3.2.1]octan-3-yl)-N-methylpentanamide (PubChem CID 61232017) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is N-(8-azabicyclo[3.2.1]octan-3-yl)-N-methylpentanamide.

Molecular Properties

Compound NameN-(8-azabicyclo[3.2.1]octan-3-yl)-N-methylpentanamide
PubChem CID61232017
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC NameN-(8-azabicyclo[3.2.1]octan-3-yl)-N-methylpentanamide
SMILESCCCCC(=O)N(C)C1CC2CCC(C1)N2
InChIInChI=1S/C13H24N2O/c1-3-4-5-13(16)15(2)12-8-10-6-7-11(9-12)14-10/h10-12,14H,3-9H2,1-2H3
InChIKeyIVQOMTGGCGUZTO-UHFFFAOYSA-N
XLogP1.92
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(azetidin-3-yl)-N-methylhexanamide
CID 66186842
N-(8-azabicyclo[3.2.1]octan-3-yl)-N-methyl-2-propan-2-yloxyacetamide
CID 112703716
N-methyl-N-piperidin-4-ylheptanamide
CID 115736784
(1R,5S)-N-methyl-N-propyl-8-azabicyclo[3.2.1]octan-3-amine
CID 26189078
N-(8-azabicyclo[3.2.1]octan-3-yl)-N-methyl-3-(3-methylphenyl)propanamide
CID 62366416
N-(8-azabicyclo[3.2.1]octan-3-yl)-N-methyl-2-(oxolan-2-yl)acetamide
CID 65160337
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-methyl-N-(4-methylcyclohexyl)acetamide
CID 79607861
3-[8-azabicyclo[3.2.1]octan-3-yl(ethyl)amino]-N,N-dimethylpropanamide
CID 61231741
2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]-N,N-dipropylacetamide
CID 61232221
N-methyl-N-[4-(propylamino)cyclohexyl]pentanamide
CID 79122715
N-(8-azabicyclo[3.2.1]octan-3-yl)-2-(4-chlorophenyl)-N-methylacetamide
CID 61232593
1-(8-azabicyclo[3.2.1]octan-3-yl)undecan-1-one
CID 171941682

Frequently Asked Questions

What is the IUPAC name of N-(8-azabicyclo[3.2.1]octan-3-yl)-N-methylpentanamide?
The IUPAC name of N-(8-azabicyclo[3.2.1]octan-3-yl)-N-methylpentanamide (CID 61232017) is N-(8-azabicyclo[3.2.1]octan-3-yl)-N-methylpentanamide.
What is the SMILES notation for N-(8-azabicyclo[3.2.1]octan-3-yl)-N-methylpentanamide?
The canonical SMILES for N-(8-azabicyclo[3.2.1]octan-3-yl)-N-methylpentanamide is CCCCC(=O)N(C)C1CC2CCC(C1)N2.
What is the InChIKey of N-(8-azabicyclo[3.2.1]octan-3-yl)-N-methylpentanamide?
The InChIKey is IVQOMTGGCGUZTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O/c1-3-4-5-13(16)15(2)12-8-10-6-7-11(9-12)14-10/h10-12,14H,3-9H2,1-2H3.
What are the key properties of N-(8-azabicyclo[3.2.1]octan-3-yl)-N-methylpentanamide?
N-(8-azabicyclo[3.2.1]octan-3-yl)-N-methylpentanamide has a molecular weight of 224.35 g/mol, XLogP of 1.92, 4 rotatable bonds, 1 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)-N-methylpentanamide is sourced from PubChem (CID 61232017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).