N-ethyl-9-[2-(1,2,4-oxadiazol-3-yl)ethyl]-9-azabicyclo[3.3.1]nonan-3-amine

C14H24N4O — CID 106408122

IUPACN-ethyl-9-[2-(1,2,4-oxadiazol-3-yl)ethyl]-9-azabicyclo[3.3.1]nonan-3-amine
SMILESCCNC1CC2CCCC(C1)N2CCc1ncon1
InChIInChI=1S/C14H24N4O/c1-2-15-11-8-12-4-3-5-13(9-11)18(12)7-6-14-16-10-19-17-14/h10-13,15H,2-9H2,1H3
InChIKeyKWCPSXJSGXYUSC-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.61
Rot. Bonds5

About N-ethyl-9-[2-(1,2,4-oxadiazol-3-yl)ethyl]-9-azabicyclo[3.3.1]nonan-3-amine

N-ethyl-9-[2-(1,2,4-oxadiazol-3-yl)ethyl]-9-azabicyclo[3.3.1]nonan-3-amine (PubChem CID 106408122) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is N-ethyl-9-[2-(1,2,4-oxadiazol-3-yl)ethyl]-9-azabicyclo[3.3.1]nonan-3-amine.

Molecular Properties

Compound NameN-ethyl-9-[2-(1,2,4-oxadiazol-3-yl)ethyl]-9-azabicyclo[3.3.1]nonan-3-amine
PubChem CID106408122
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC NameN-ethyl-9-[2-(1,2,4-oxadiazol-3-yl)ethyl]-9-azabicyclo[3.3.1]nonan-3-amine
SMILESCCNC1CC2CCCC(C1)N2CCc1ncon1
InChIInChI=1S/C14H24N4O/c1-2-15-11-8-12-4-3-5-13(9-11)18(12)7-6-14-16-10-19-17-14/h10-13,15H,2-9H2,1H3
InChIKeyKWCPSXJSGXYUSC-UHFFFAOYSA-N
XLogP1.61
TPSA54.19 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-ethyl-9-[2-(1,2,4-oxadiazol-3-yl)ethyl]-9-azabicyclo[3.3.1]nonan-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-ethyl-2-methyl-1-[2-(1,2,4-oxadiazol-3-yl)ethyl]piperidin-4-amine
CID 106402270
N-ethyl-9-propyl-9-azabicyclo[3.3.1]nonan-3-amine
CID 62712172
N-ethyl-9-[2-(furan-2-yl)ethyl]-9-azabicyclo[3.3.1]nonan-3-amine
CID 62713661
N-[2-(1,2,4-oxadiazol-3-yl)ethyl]cyclobutanamine
CID 106396081
9-(cyclobutylmethyl)-N-ethyl-9-azabicyclo[3.3.1]nonan-3-amine
CID 62713983
N-ethyl-9-prop-2-enyl-9-azabicyclo[3.3.1]nonan-3-amine
CID 62712214
N-ethyl-9-(pyridin-2-ylmethyl)-9-azabicyclo[3.3.1]nonan-3-amine
CID 55105886
N-ethyl-9-(1,2-oxazol-5-ylmethyl)-9-azabicyclo[3.3.1]nonan-3-amine
CID 106421181
2,6-dimethyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]cyclohexan-1-amine
CID 106395561
9-(1,2-oxazol-3-ylmethyl)-N-propyl-9-azabicyclo[3.3.1]nonan-3-amine
CID 81173487
N-ethyl-9-(furan-2-ylmethyl)-9-azabicyclo[3.3.1]nonan-3-amine
CID 62712896
1-methyl-N-(1,2,4-oxadiazol-3-ylmethyl)piperidin-4-amine
CID 103649301

Frequently Asked Questions

What is the IUPAC name of N-ethyl-9-[2-(1,2,4-oxadiazol-3-yl)ethyl]-9-azabicyclo[3.3.1]nonan-3-amine?
The IUPAC name of N-ethyl-9-[2-(1,2,4-oxadiazol-3-yl)ethyl]-9-azabicyclo[3.3.1]nonan-3-amine (CID 106408122) is N-ethyl-9-[2-(1,2,4-oxadiazol-3-yl)ethyl]-9-azabicyclo[3.3.1]nonan-3-amine.
What is the SMILES notation for N-ethyl-9-[2-(1,2,4-oxadiazol-3-yl)ethyl]-9-azabicyclo[3.3.1]nonan-3-amine?
The canonical SMILES for N-ethyl-9-[2-(1,2,4-oxadiazol-3-yl)ethyl]-9-azabicyclo[3.3.1]nonan-3-amine is CCNC1CC2CCCC(C1)N2CCc1ncon1.
What is the InChIKey of N-ethyl-9-[2-(1,2,4-oxadiazol-3-yl)ethyl]-9-azabicyclo[3.3.1]nonan-3-amine?
The InChIKey is KWCPSXJSGXYUSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-2-15-11-8-12-4-3-5-13(9-11)18(12)7-6-14-16-10-19-17-14/h10-13,15H,2-9H2,1H3.
What are the key properties of N-ethyl-9-[2-(1,2,4-oxadiazol-3-yl)ethyl]-9-azabicyclo[3.3.1]nonan-3-amine?
N-ethyl-9-[2-(1,2,4-oxadiazol-3-yl)ethyl]-9-azabicyclo[3.3.1]nonan-3-amine has a molecular weight of 264.37 g/mol, XLogP of 1.61, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-9-[2-(1,2,4-oxadiazol-3-yl)ethyl]-9-azabicyclo[3.3.1]nonan-3-amine is sourced from PubChem (CID 106408122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).