ethane;10-methyl-10-azatricyclo[6.4.1.04,13]tridecane

C15H29N — CID 145098920

IUPACethane;10-methyl-10-azatricyclo[6.4.1.04,13]tridecane
SMILESCC.CN1CCC2CCC3CCCC(C1)C32
InChIInChI=1S/C13H23N.C2H6/c1-14-8-7-11-6-5-10-3-2-4-12(9-14)13(10)11;1-2/h10-13H,2-9H2,1H3;1-2H3
InChIKeyMHLILMBABROLTR-UHFFFAOYSA-N
MW223.40 g/mol
LogP3.79
Rot. Bonds

About ethane;10-methyl-10-azatricyclo[6.4.1.04,13]tridecane

ethane;10-methyl-10-azatricyclo[6.4.1.04,13]tridecane (PubChem CID 145098920) has the molecular formula C15H29N and a molecular weight of 223.40 g/mol. Its IUPAC name is ethane;10-methyl-10-azatricyclo[6.4.1.04,13]tridecane.

Molecular Properties

Compound Nameethane;10-methyl-10-azatricyclo[6.4.1.04,13]tridecane
PubChem CID145098920
Molecular FormulaC15H29N
Molecular Weight223.40 g/mol
Exact Mass223.23
IUPAC Nameethane;10-methyl-10-azatricyclo[6.4.1.04,13]tridecane
SMILESCC.CN1CCC2CCC3CCCC(C1)C32
InChIInChI=1S/C13H23N.C2H6/c1-14-8-7-11-6-5-10-3-2-4-12(9-14)13(10)11;1-2/h10-13H,2-9H2,1H3;1-2H3
InChIKeyMHLILMBABROLTR-UHFFFAOYSA-N
XLogP3.79
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.40
LogP ≤ 53.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze ethane;10-methyl-10-azatricyclo[6.4.1.04,13]tridecane 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

3-methyl-7-propan-2-yl-2,4,5,5a,6,7,8,8a-octahydro-1H-cyclopenta[d]azepine
CID 58179686
2-methyl-7-propan-2-yl-3,4,5,5a,6,7,8,8a-octahydro-1H-cyclopenta[c]azepine
CID 58179775
10-Ethyl-10-azatricyclo[6.3.1.02,7]dodecane
CID 141202789
7-Ethyl-2-methyl-1,3,4,4a,5,5a,6,7,8,8a,9,9a-dodecahydrocyclopenta[g]isoquinoline
CID 169875948
10-Methyl-10-azatricyclo[6.4.1.04,13]tridecane
CID 145098921

Frequently Asked Questions

What is the IUPAC name of ethane;10-methyl-10-azatricyclo[6.4.1.04,13]tridecane?
The IUPAC name of ethane;10-methyl-10-azatricyclo[6.4.1.04,13]tridecane (CID 145098920) is ethane;10-methyl-10-azatricyclo[6.4.1.04,13]tridecane.
What is the SMILES notation for ethane;10-methyl-10-azatricyclo[6.4.1.04,13]tridecane?
The canonical SMILES for ethane;10-methyl-10-azatricyclo[6.4.1.04,13]tridecane is CC.CN1CCC2CCC3CCCC(C1)C32.
What is the InChIKey of ethane;10-methyl-10-azatricyclo[6.4.1.04,13]tridecane?
The InChIKey is MHLILMBABROLTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N.C2H6/c1-14-8-7-11-6-5-10-3-2-4-12(9-14)13(10)11;1-2/h10-13H,2-9H2,1H3;1-2H3.
What are the key properties of ethane;10-methyl-10-azatricyclo[6.4.1.04,13]tridecane?
ethane;10-methyl-10-azatricyclo[6.4.1.04,13]tridecane has a molecular weight of 223.40 g/mol, XLogP of 3.79, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;10-methyl-10-azatricyclo[6.4.1.04,13]tridecane is sourced from PubChem (CID 145098920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).