2-[(2,3-dimethyl-2-azabicyclo[3.1.0]hexan-5-yl)methyl]-2-azaspiro[3.3]heptane;ethane

C18H36N2 — CID 168939147

IUPAC2-[(2,3-dimethyl-2-azabicyclo[3.1.0]hexan-5-yl)methyl]-2-azaspiro[3.3]heptane;ethane
SMILESCC.CC.CC1CC2(CN3CC4(CCC4)C3)CC2N1C
InChIInChI=1S/C14H24N2.2C2H6/c1-11-6-14(7-12(14)15(11)2)10-16-8-13(9-16)4-3-5-13;2*1-2/h11-12H,3-10H2,1-2H3;2*1-2H3
InChIKeyRAQGPDXLHNTGTM-UHFFFAOYSA-N
MW280.50 g/mol
LogP4.01
Rot. Bonds2

About 2-[(2,3-dimethyl-2-azabicyclo[3.1.0]hexan-5-yl)methyl]-2-azaspiro[3.3]heptane;ethane

2-[(2,3-dimethyl-2-azabicyclo[3.1.0]hexan-5-yl)methyl]-2-azaspiro[3.3]heptane;ethane (PubChem CID 168939147) has the molecular formula C18H36N2 and a molecular weight of 280.50 g/mol. Its IUPAC name is 2-[(2,3-dimethyl-2-azabicyclo[3.1.0]hexan-5-yl)methyl]-2-azaspiro[3.3]heptane;ethane.

Molecular Properties

Compound Name2-[(2,3-dimethyl-2-azabicyclo[3.1.0]hexan-5-yl)methyl]-2-azaspiro[3.3]heptane;ethane
PubChem CID168939147
Molecular FormulaC18H36N2
Molecular Weight280.50 g/mol
Exact Mass280.29
IUPAC Name2-[(2,3-dimethyl-2-azabicyclo[3.1.0]hexan-5-yl)methyl]-2-azaspiro[3.3]heptane;ethane
SMILESCC.CC.CC1CC2(CN3CC4(CCC4)C3)CC2N1C
InChIInChI=1S/C14H24N2.2C2H6/c1-11-6-14(7-12(14)15(11)2)10-16-8-13(9-16)4-3-5-13;2*1-2/h11-12H,3-10H2,1-2H3;2*1-2H3
InChIKeyRAQGPDXLHNTGTM-UHFFFAOYSA-N
XLogP4.01
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.50
LogP ≤ 54.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-[(2,3-dimethyl-2-azabicyclo[3.1.0]hexan-5-yl)methyl]-2-azaspiro[3.3]heptane;ethane 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

2-[[(3R)-2-tert-butyl-3-methyl-2-azabicyclo[3.1.0]hexan-5-yl]methyl]-2-azaspiro[3.3]heptane
CID 176632123
5-(methoxymethyl)-2,3-dimethyl-2-azabicyclo[3.1.0]hexane
CID 171817491
2-methyl-2-azaspiro[3.3]heptane
CID 22975634
2-ethyl-2-azaspiro[3.3]heptane
CID 130337259
2-(2-methylpropyl)-2-azaspiro[3.3]heptane
CID 118300646
2-butyl-2-azaspiro[3.3]heptane
CID 170365296
ethane;2-methyl-2-azaspiro[3.6]decane
CID 90761663
(8R)-6-methyl-8-propan-2-yl-6-azaspiro[3.5]nonane
CID 129290560
2-(2-azaspiro[3.3]heptan-2-yl)ethanamine
CID 55289039
1-(2-azaspiro[3.3]heptan-2-yl)propan-2-amine
CID 79678743
2-(2,2-dimethylpropyl)-2-azaspiro[3.3]heptane
CID 90140966
2-(3-propan-2-yloxypropyl)-2-azaspiro[3.3]heptane
CID 138616757

Frequently Asked Questions

What is the IUPAC name of 2-[(2,3-dimethyl-2-azabicyclo[3.1.0]hexan-5-yl)methyl]-2-azaspiro[3.3]heptane;ethane?
The IUPAC name of 2-[(2,3-dimethyl-2-azabicyclo[3.1.0]hexan-5-yl)methyl]-2-azaspiro[3.3]heptane;ethane (CID 168939147) is 2-[(2,3-dimethyl-2-azabicyclo[3.1.0]hexan-5-yl)methyl]-2-azaspiro[3.3]heptane;ethane.
What is the SMILES notation for 2-[(2,3-dimethyl-2-azabicyclo[3.1.0]hexan-5-yl)methyl]-2-azaspiro[3.3]heptane;ethane?
The canonical SMILES for 2-[(2,3-dimethyl-2-azabicyclo[3.1.0]hexan-5-yl)methyl]-2-azaspiro[3.3]heptane;ethane is CC.CC.CC1CC2(CN3CC4(CCC4)C3)CC2N1C.
What is the InChIKey of 2-[(2,3-dimethyl-2-azabicyclo[3.1.0]hexan-5-yl)methyl]-2-azaspiro[3.3]heptane;ethane?
The InChIKey is RAQGPDXLHNTGTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2.2C2H6/c1-11-6-14(7-12(14)15(11)2)10-16-8-13(9-16)4-3-5-13;2*1-2/h11-12H,3-10H2,1-2H3;2*1-2H3.
What are the key properties of 2-[(2,3-dimethyl-2-azabicyclo[3.1.0]hexan-5-yl)methyl]-2-azaspiro[3.3]heptane;ethane?
2-[(2,3-dimethyl-2-azabicyclo[3.1.0]hexan-5-yl)methyl]-2-azaspiro[3.3]heptane;ethane has a molecular weight of 280.50 g/mol, XLogP of 4.01, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,3-dimethyl-2-azabicyclo[3.1.0]hexan-5-yl)methyl]-2-azaspiro[3.3]heptane;ethane is sourced from PubChem (CID 168939147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).