2-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)amino]propanamide

C11H21N3O — CID 43545311

IUPAC2-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)amino]propanamide
SMILESCC(NC1CC2CCC(C1)N2C)C(N)=O
InChIInChI=1S/C11H21N3O/c1-7(11(12)15)13-8-5-9-3-4-10(6-8)14(9)2/h7-10,13H,3-6H2,1-2H3,(H2,12,15)
InChIKeyRYCHVMNERNZVFQ-UHFFFAOYSA-N
MW211.31 g/mol
LogP0.08
Rot. Bonds3

About 2-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)amino]propanamide

2-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)amino]propanamide (PubChem CID 43545311) has the molecular formula C11H21N3O and a molecular weight of 211.31 g/mol. Its IUPAC name is 2-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)amino]propanamide.

Molecular Properties

Compound Name2-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)amino]propanamide
PubChem CID43545311
Molecular FormulaC11H21N3O
Molecular Weight211.31 g/mol
Exact Mass211.17
IUPAC Name2-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)amino]propanamide
SMILESCC(NC1CC2CCC(C1)N2C)C(N)=O
InChIInChI=1S/C11H21N3O/c1-7(11(12)15)13-8-5-9-3-4-10(6-8)14(9)2/h7-10,13H,3-6H2,1-2H3,(H2,12,15)
InChIKeyRYCHVMNERNZVFQ-UHFFFAOYSA-N
XLogP0.08
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 50.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(8-Aza-bicyclo[3.2.1]oct-3-yl)-acetamide
CID 652782
cis-N-[2-(2,6-dimethyl-1-piperidinyl)ethyl]-2-oxo-1-pyrrolidineacetamide
CID 44374502
Cyclopropanecarboxylic acid (8-carbamoylmethyl-8-aza-bicyclo[3.2.1]oct-3-yl)-amide
CID 650271
N-[3-(2,6-dimethylpiperidin-1-yl)propyl]-2-(2-oxopyrrolidin-1-yl)propanamide
CID 21327793
N-[2-(2,6-dimethylpiperidin-1-yl)ethyl]-2-(2-oxopyrrolidin-1-yl)propanamide
CID 21327810
N-[2-[(2S,6S)-2,6-dimethylpiperidin-1-yl]ethyl]-2-(2-oxopyrrolidin-1-yl)acetamide
CID 44374491
N-[4-(2,6-dimethylpiperidin-1-yl)butyl]-2-(2-oxopyrrolidin-1-yl)acetamide
CID 44374676
N-[3-(2,6-dimethylpiperidin-1-yl)propyl]-2-(2-oxopyrrolidin-1-yl)acetamide
CID 44374687
N-[3-(2-Methylpiperidin-1-yl)propyl]-2-(2-oxopyrrolidin-1-yl)acetamide
CID 44374716
N-[3-(2,6-dimethylpiperidin-1-yl)propyl]-2-(2-methyl-5-oxopyrrolidin-1-yl)acetamide
CID 44374960
1-[(3S)-3-(cycloheptylamino)pyrrolidin-1-yl]propan-1-one
CID 97095100
1-Cycloheptyl-4-[(1-methyl-4-piperidinyl)amino]-2-pyrrolidinone
CID 45197066

Frequently Asked Questions

What is the IUPAC name of 2-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)amino]propanamide?
The IUPAC name of 2-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)amino]propanamide (CID 43545311) is 2-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)amino]propanamide.
What is the SMILES notation for 2-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)amino]propanamide?
The canonical SMILES for 2-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)amino]propanamide is CC(NC1CC2CCC(C1)N2C)C(N)=O.
What is the InChIKey of 2-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)amino]propanamide?
The InChIKey is RYCHVMNERNZVFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O/c1-7(11(12)15)13-8-5-9-3-4-10(6-8)14(9)2/h7-10,13H,3-6H2,1-2H3,(H2,12,15).
What are the key properties of 2-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)amino]propanamide?
2-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)amino]propanamide has a molecular weight of 211.31 g/mol, XLogP of 0.08, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)amino]propanamide is sourced from PubChem (CID 43545311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).