N,N-dimethyl-1-azabicyclo[3.2.1]octane-7-carboxamide

C10H18N2O — CID 121227558

IUPACN,N-dimethyl-1-azabicyclo[3.2.1]octane-7-carboxamide
SMILESCN(C)C(=O)C1CC2CCCN1C2
InChIInChI=1S/C10H18N2O/c1-11(2)10(13)9-6-8-4-3-5-12(9)7-8/h8-9H,3-7H2,1-2H3
InChIKeyIXFFSQUSZLKDRE-UHFFFAOYSA-N
MW182.27 g/mol
LogP0.56
Rot. Bonds1

About N,N-dimethyl-1-azabicyclo[3.2.1]octane-7-carboxamide

N,N-dimethyl-1-azabicyclo[3.2.1]octane-7-carboxamide (PubChem CID 121227558) has the molecular formula C10H18N2O and a molecular weight of 182.27 g/mol. Its IUPAC name is N,N-dimethyl-1-azabicyclo[3.2.1]octane-7-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-1-azabicyclo[3.2.1]octane-7-carboxamide
PubChem CID121227558
Molecular FormulaC10H18N2O
Molecular Weight182.27 g/mol
Exact Mass182.14
IUPAC NameN,N-dimethyl-1-azabicyclo[3.2.1]octane-7-carboxamide
SMILESCN(C)C(=O)C1CC2CCCN1C2
InChIInChI=1S/C10H18N2O/c1-11(2)10(13)9-6-8-4-3-5-12(9)7-8/h8-9H,3-7H2,1-2H3
InChIKeyIXFFSQUSZLKDRE-UHFFFAOYSA-N
XLogP0.56
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.27
LogP ≤ 50.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

methyl 1-azabicyclo[2.2.1]heptane-2-carboxylate
CID 67858492
2-(dimethylcarbamoyl)pyrrolidine-1-carboxylic acid
CID 89401620
N,N-dimethyl-1,2,3,5,6,7,8,8a-octahydroindolizine-7-carboxamide
CID 170356993
N,N,2-trimethyl-1,3,4,4a,5,6,7,8,9,9a-decahydrocyclohepta[c]pyridine-3-carboxamide
CID 20624795
ethyl 2-(dimethylcarbamoyl)pyrrolidine-1-carboxylate
CID 60700666
1-(cyclopropanecarbonyl)-N,N-dimethylpyrrolidine-2-carboxamide
CID 60717815
1-(2,2-dimethylpropanoyl)-N,N-dimethylpyrrolidine-2-carboxamide
CID 60858063
1-azabicyclo[10.2.1]pentadec-8-ene-14-carboxylic acid
CID 68521535
(2S)-1-(2-cyanoethyl)-N,N-dimethylpyrrolidine-2-carboxamide
CID 59131193
N,N-dimethyl-1-[2-[methyl(propan-2-yl)amino]-2-oxoethyl]pyrrolidine-2-carboxamide
CID 86913220
(2S)-1-[(2S)-1-[(2S)-1-acetylpyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]-N,N-dimethylpyrrolidine-2-carboxamide
CID 101411336
1-(3-aminocyclohexyl)-N,N-dimethylpyrrolidine-2-carboxamide
CID 79468167

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-azabicyclo[3.2.1]octane-7-carboxamide?
The IUPAC name of N,N-dimethyl-1-azabicyclo[3.2.1]octane-7-carboxamide (CID 121227558) is N,N-dimethyl-1-azabicyclo[3.2.1]octane-7-carboxamide.
What is the SMILES notation for N,N-dimethyl-1-azabicyclo[3.2.1]octane-7-carboxamide?
The canonical SMILES for N,N-dimethyl-1-azabicyclo[3.2.1]octane-7-carboxamide is CN(C)C(=O)C1CC2CCCN1C2.
What is the InChIKey of N,N-dimethyl-1-azabicyclo[3.2.1]octane-7-carboxamide?
The InChIKey is IXFFSQUSZLKDRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O/c1-11(2)10(13)9-6-8-4-3-5-12(9)7-8/h8-9H,3-7H2,1-2H3.
What are the key properties of N,N-dimethyl-1-azabicyclo[3.2.1]octane-7-carboxamide?
N,N-dimethyl-1-azabicyclo[3.2.1]octane-7-carboxamide has a molecular weight of 182.27 g/mol, XLogP of 0.56, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-azabicyclo[3.2.1]octane-7-carboxamide is sourced from PubChem (CID 121227558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).