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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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).