N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)pyrrolidine-3-carboxamide

C14H25N3O — CID 65470856

IUPACN-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)pyrrolidine-3-carboxamide
SMILESCN1C2CCCC1CC(NC(=O)C1CCNC1)C2
InChIInChI=1S/C14H25N3O/c1-17-12-3-2-4-13(17)8-11(7-12)16-14(18)10-5-6-15-9-10/h10-13,15H,2-9H2,1H3,(H,16,18)
InChIKeyQHZICRVKLAZNFL-UHFFFAOYSA-N
MW251.37 g/mol
LogP0.73
Rot. Bonds2

About N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)pyrrolidine-3-carboxamide

N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)pyrrolidine-3-carboxamide (PubChem CID 65470856) has the molecular formula C14H25N3O and a molecular weight of 251.37 g/mol. Its IUPAC name is N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)pyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)pyrrolidine-3-carboxamide
PubChem CID65470856
Molecular FormulaC14H25N3O
Molecular Weight251.37 g/mol
Exact Mass251.20
IUPAC NameN-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)pyrrolidine-3-carboxamide
SMILESCN1C2CCCC1CC(NC(=O)C1CCNC1)C2
InChIInChI=1S/C14H25N3O/c1-17-12-3-2-4-13(17)8-11(7-12)16-14(18)10-5-6-15-9-10/h10-13,15H,2-9H2,1H3,(H,16,18)
InChIKeyQHZICRVKLAZNFL-UHFFFAOYSA-N
XLogP0.73
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 50.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)cyclohexane-1-carboxamide
CID 65472567
N-(3-propan-2-ylcyclohexyl)pyrrolidine-3-carboxamide;hydrochloride
CID 119775883
N-(1-cyclohexylpiperidin-4-yl)pyrrolidine-3-carboxamide
CID 119895220
6-methyl-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)piperidine-2-carboxamide
CID 65471266
3-amino-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)cyclohexane-1-carboxamide;dihydrochloride
CID 119892062
N-[(3R)-pyrrolidin-3-yl]piperidine-4-carboxamide
CID 91470745
(3R)-N-(3,5-dimethylcyclohexyl)piperidine-3-carboxamide
CID 81134524
N-(3,4-dimethylcyclohexyl)pyrrolidine-3-carboxamide
CID 64741940
N-(4-propan-2-ylcyclohexyl)pyrrolidine-3-carboxamide;hydrochloride
CID 119812040
[(1S,5R)-9-methyl-9-azabicyclo[3.3.1]nonan-3-yl]urea
CID 70078455
(3S)-N-cyclobutylpiperidine-3-carboxamide
CID 81141296
methyl N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)carbamate
CID 115661200

Frequently Asked Questions

What is the IUPAC name of N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)pyrrolidine-3-carboxamide?
The IUPAC name of N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)pyrrolidine-3-carboxamide (CID 65470856) is N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)pyrrolidine-3-carboxamide.
What is the SMILES notation for N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)pyrrolidine-3-carboxamide?
The canonical SMILES for N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)pyrrolidine-3-carboxamide is CN1C2CCCC1CC(NC(=O)C1CCNC1)C2.
What is the InChIKey of N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)pyrrolidine-3-carboxamide?
The InChIKey is QHZICRVKLAZNFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O/c1-17-12-3-2-4-13(17)8-11(7-12)16-14(18)10-5-6-15-9-10/h10-13,15H,2-9H2,1H3,(H,16,18).
What are the key properties of N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)pyrrolidine-3-carboxamide?
N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)pyrrolidine-3-carboxamide has a molecular weight of 251.37 g/mol, XLogP of 0.73, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)pyrrolidine-3-carboxamide is sourced from PubChem (CID 65470856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).