N,N-dimethyl-3-propan-2-yl-8-azabicyclo[3.2.1]octane-8-carboxamide

C13H24N2O — CID 59598958

IUPACN,N-dimethyl-3-propan-2-yl-8-azabicyclo[3.2.1]octane-8-carboxamide
SMILESCC(C)C1CC2CCC(C1)N2C(=O)N(C)C
InChIInChI=1S/C13H24N2O/c1-9(2)10-7-11-5-6-12(8-10)15(11)13(16)14(3)4/h9-12H,5-8H2,1-4H3
InChIKeyTVGXCCPUEYVZRX-UHFFFAOYSA-N
MW224.35 g/mol
LogP2.57
Rot. Bonds1

About N,N-dimethyl-3-propan-2-yl-8-azabicyclo[3.2.1]octane-8-carboxamide

N,N-dimethyl-3-propan-2-yl-8-azabicyclo[3.2.1]octane-8-carboxamide (PubChem CID 59598958) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is N,N-dimethyl-3-propan-2-yl-8-azabicyclo[3.2.1]octane-8-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-3-propan-2-yl-8-azabicyclo[3.2.1]octane-8-carboxamide
PubChem CID59598958
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC NameN,N-dimethyl-3-propan-2-yl-8-azabicyclo[3.2.1]octane-8-carboxamide
SMILESCC(C)C1CC2CCC(C1)N2C(=O)N(C)C
InChIInChI=1S/C13H24N2O/c1-9(2)10-7-11-5-6-12(8-10)15(11)13(16)14(3)4/h9-12H,5-8H2,1-4H3
InChIKeyTVGXCCPUEYVZRX-UHFFFAOYSA-N
XLogP2.57
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-3-propan-2-yl-8-azabicyclo[3.2.1]octane-8-carboxamide?
The IUPAC name of N,N-dimethyl-3-propan-2-yl-8-azabicyclo[3.2.1]octane-8-carboxamide (CID 59598958) is N,N-dimethyl-3-propan-2-yl-8-azabicyclo[3.2.1]octane-8-carboxamide.
What is the SMILES notation for N,N-dimethyl-3-propan-2-yl-8-azabicyclo[3.2.1]octane-8-carboxamide?
The canonical SMILES for N,N-dimethyl-3-propan-2-yl-8-azabicyclo[3.2.1]octane-8-carboxamide is CC(C)C1CC2CCC(C1)N2C(=O)N(C)C.
What is the InChIKey of N,N-dimethyl-3-propan-2-yl-8-azabicyclo[3.2.1]octane-8-carboxamide?
The InChIKey is TVGXCCPUEYVZRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O/c1-9(2)10-7-11-5-6-12(8-10)15(11)13(16)14(3)4/h9-12H,5-8H2,1-4H3.
What are the key properties of N,N-dimethyl-3-propan-2-yl-8-azabicyclo[3.2.1]octane-8-carboxamide?
N,N-dimethyl-3-propan-2-yl-8-azabicyclo[3.2.1]octane-8-carboxamide has a molecular weight of 224.35 g/mol, XLogP of 2.57, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-3-propan-2-yl-8-azabicyclo[3.2.1]octane-8-carboxamide is sourced from PubChem (CID 59598958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).