5-ethyl-4-methyl-4-azabicyclo[10.3.1]hexadecane

C18H35N — CID 170112638

IUPAC5-ethyl-4-methyl-4-azabicyclo[10.3.1]hexadecane
SMILESCCC1CCCCCCC2CCCC(CCN1C)C2
InChIInChI=1S/C18H35N/c1-3-18-12-7-5-4-6-9-16-10-8-11-17(15-16)13-14-19(18)2/h16-18H,3-15H2,1-2H3
InChIKeySSIDBYXZLIDAKZ-UHFFFAOYSA-N
MW265.48 g/mol
LogP5.25
Rot. Bonds1

About 5-ethyl-4-methyl-4-azabicyclo[10.3.1]hexadecane

5-ethyl-4-methyl-4-azabicyclo[10.3.1]hexadecane (PubChem CID 170112638) has the molecular formula C18H35N and a molecular weight of 265.48 g/mol. Its IUPAC name is 5-ethyl-4-methyl-4-azabicyclo[10.3.1]hexadecane.

Molecular Properties

Compound Name5-ethyl-4-methyl-4-azabicyclo[10.3.1]hexadecane
PubChem CID170112638
Molecular FormulaC18H35N
Molecular Weight265.48 g/mol
Exact Mass265.28
IUPAC Name5-ethyl-4-methyl-4-azabicyclo[10.3.1]hexadecane
SMILESCCC1CCCCCCC2CCCC(CCN1C)C2
InChIInChI=1S/C18H35N/c1-3-18-12-7-5-4-6-9-16-10-8-11-17(15-16)13-14-19(18)2/h16-18H,3-15H2,1-2H3
InChIKeySSIDBYXZLIDAKZ-UHFFFAOYSA-N
XLogP5.25
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500265.48
LogP ≤ 55.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 5-ethyl-4-methyl-4-azabicyclo[10.3.1]hexadecane 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

(2R)-2-ethyl-1-methylpiperidine
CID 67552955
(2R)-2-ethyl-1-methylpyrrolidine;hydrofluoride
CID 162730747
bicyclo[5.3.1]undecane
CID 14399147
2-ethyl-1-azabicyclo[7.3.1]tridecane
CID 130354528
2,7-diethyl-1-methylazepane
CID 146499185
1-methyl-2-pent-2-enylpiperidine
CID 175484811
bicyclo[4.3.1]decane
CID 12592588
(1S,6R)-bicyclo[4.3.1]decane
CID 58154231
(2R,3aS,7aS)-2-ethyl-1-methyl-2,3,3a,4,5,6,7,7a-octahydroindole;(2R)-2-ethyl-1-methylpyrrolidine
CID 159513333
1-methyl-2-[(1-methylpiperidin-2-yl)methyl]piperidine
CID 54394556
2,6-diethyl-1-propylpiperidine
CID 170625295
(5R)-3-ethylbicyclo[3.3.1]nonane
CID 59897306

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-4-methyl-4-azabicyclo[10.3.1]hexadecane?
The IUPAC name of 5-ethyl-4-methyl-4-azabicyclo[10.3.1]hexadecane (CID 170112638) is 5-ethyl-4-methyl-4-azabicyclo[10.3.1]hexadecane.
What is the SMILES notation for 5-ethyl-4-methyl-4-azabicyclo[10.3.1]hexadecane?
The canonical SMILES for 5-ethyl-4-methyl-4-azabicyclo[10.3.1]hexadecane is CCC1CCCCCCC2CCCC(CCN1C)C2.
What is the InChIKey of 5-ethyl-4-methyl-4-azabicyclo[10.3.1]hexadecane?
The InChIKey is SSIDBYXZLIDAKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H35N/c1-3-18-12-7-5-4-6-9-16-10-8-11-17(15-16)13-14-19(18)2/h16-18H,3-15H2,1-2H3.
What are the key properties of 5-ethyl-4-methyl-4-azabicyclo[10.3.1]hexadecane?
5-ethyl-4-methyl-4-azabicyclo[10.3.1]hexadecane has a molecular weight of 265.48 g/mol, XLogP of 5.25, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-4-methyl-4-azabicyclo[10.3.1]hexadecane is sourced from PubChem (CID 170112638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).