N-methyl-3-azabicyclo[3.3.1]nonane-3-carboxamide

C10H18N2O — CID 130479696

IUPACN-methyl-3-azabicyclo[3.3.1]nonane-3-carboxamide
SMILESCNC(=O)N1CC2CCCC(C2)C1
InChIInChI=1S/C10H18N2O/c1-11-10(13)12-6-8-3-2-4-9(5-8)7-12/h8-9H,2-7H2,1H3,(H,11,13)
InChIKeyUUXICSQROUPKJO-UHFFFAOYSA-N
MW182.27 g/mol
LogP1.45
Rot. Bonds

About N-methyl-3-azabicyclo[3.3.1]nonane-3-carboxamide

N-methyl-3-azabicyclo[3.3.1]nonane-3-carboxamide (PubChem CID 130479696) has the molecular formula C10H18N2O and a molecular weight of 182.27 g/mol. Its IUPAC name is N-methyl-3-azabicyclo[3.3.1]nonane-3-carboxamide.

Molecular Properties

Compound NameN-methyl-3-azabicyclo[3.3.1]nonane-3-carboxamide
PubChem CID130479696
Molecular FormulaC10H18N2O
Molecular Weight182.27 g/mol
Exact Mass182.14
IUPAC NameN-methyl-3-azabicyclo[3.3.1]nonane-3-carboxamide
SMILESCNC(=O)N1CC2CCCC(C2)C1
InChIInChI=1S/C10H18N2O/c1-11-10(13)12-6-8-3-2-4-9(5-8)7-12/h8-9H,2-7H2,1H3,(H,11,13)
InChIKeyUUXICSQROUPKJO-UHFFFAOYSA-N
XLogP1.45
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.27
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-(3-azabicyclo[3.3.1]nonane-3-carbonylamino)butanoic acid
CID 114196661
3-tert-butyl-N-methylazetidine-1-carboxamide
CID 164830177
3-azabicyclo[3.3.1]nonan-3-yl-[5-(methylamino)-1,3,4-thiadiazol-2-yl]methanone
CID 114196780
1-(3-azabicyclo[3.3.1]nonan-3-yl)-2-(cyclopentylamino)ethanone
CID 114196416
[2-[(1S,5S)-3-azabicyclo[3.3.1]nonan-3-yl]-2-oxoethyl]urea
CID 131915772
chloromethyl 3-azabicyclo[3.3.1]nonane-3-carboxylate
CID 164660409
(1R,9R)-N-methyl-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-diene-11-carboxamide
CID 40542666
(1R,9S)-N-methyl-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-diene-11-carboxamide
CID 163034267
3-methylsulfonyl-3-azabicyclo[3.3.1]nonane
CID 130479813
3-azabicyclo[3.3.1]nonan-3-yl-[1-(2-methoxyethyl)piperidin-4-yl]methanone
CID 171153397
methyl 3-[(1R,5R)-3-azabicyclo[3.3.1]nonan-3-yl]propanoate
CID 129374649
methyl 2-(3-azabicyclo[3.3.1]nonan-3-yl)propanoate
CID 130479743

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-azabicyclo[3.3.1]nonane-3-carboxamide?
The IUPAC name of N-methyl-3-azabicyclo[3.3.1]nonane-3-carboxamide (CID 130479696) is N-methyl-3-azabicyclo[3.3.1]nonane-3-carboxamide.
What is the SMILES notation for N-methyl-3-azabicyclo[3.3.1]nonane-3-carboxamide?
The canonical SMILES for N-methyl-3-azabicyclo[3.3.1]nonane-3-carboxamide is CNC(=O)N1CC2CCCC(C2)C1.
What is the InChIKey of N-methyl-3-azabicyclo[3.3.1]nonane-3-carboxamide?
The InChIKey is UUXICSQROUPKJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O/c1-11-10(13)12-6-8-3-2-4-9(5-8)7-12/h8-9H,2-7H2,1H3,(H,11,13).
What are the key properties of N-methyl-3-azabicyclo[3.3.1]nonane-3-carboxamide?
N-methyl-3-azabicyclo[3.3.1]nonane-3-carboxamide has a molecular weight of 182.27 g/mol, XLogP of 1.45, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-azabicyclo[3.3.1]nonane-3-carboxamide is sourced from PubChem (CID 130479696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).