3,4-bis(2-methylpropyl)-1,4-diazaspiro[5.5]undecane

C17H34N2 — CID 64876468

IUPAC3,4-bis(2-methylpropyl)-1,4-diazaspiro[5.5]undecane
SMILESCC(C)CC1CNC2(CCCCC2)CN1CC(C)C
InChIInChI=1S/C17H34N2/c1-14(2)10-16-11-18-17(8-6-5-7-9-17)13-19(16)12-15(3)4/h14-16,18H,5-13H2,1-4H3
InChIKeyAQDLNSHUVHRUDQ-UHFFFAOYSA-N
MW266.47 g/mol
LogP3.67
Rot. Bonds4

About 3,4-bis(2-methylpropyl)-1,4-diazaspiro[5.5]undecane

3,4-bis(2-methylpropyl)-1,4-diazaspiro[5.5]undecane (PubChem CID 64876468) has the molecular formula C17H34N2 and a molecular weight of 266.47 g/mol. Its IUPAC name is 3,4-bis(2-methylpropyl)-1,4-diazaspiro[5.5]undecane.

Molecular Properties

Compound Name3,4-bis(2-methylpropyl)-1,4-diazaspiro[5.5]undecane
PubChem CID64876468
Molecular FormulaC17H34N2
Molecular Weight266.47 g/mol
Exact Mass266.27
IUPAC Name3,4-bis(2-methylpropyl)-1,4-diazaspiro[5.5]undecane
SMILESCC(C)CC1CNC2(CCCCC2)CN1CC(C)C
InChIInChI=1S/C17H34N2/c1-14(2)10-16-11-18-17(8-6-5-7-9-17)13-19(16)12-15(3)4/h14-16,18H,5-13H2,1-4H3
InChIKeyAQDLNSHUVHRUDQ-UHFFFAOYSA-N
XLogP3.67
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.47
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3,4-bis(2-methylpropyl)-1,4-diazaspiro[5.5]undecane 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-4-(2-methylpropyl)-1,4-diazaspiro[5.5]undecane
CID 64877798
9-[(E)-3-chloroprop-2-enyl]-8-(2-methylpropyl)-6,9-diazaspiro[4.5]decane
CID 114014122
8-(2-methylpropyl)-9-(3,3,3-trifluoropropyl)-6,9-diazaspiro[4.5]decane
CID 64876420
8-(2-methylpropyl)-9-(2-propan-2-yloxyethyl)-6,9-diazaspiro[4.5]decane
CID 64878149
4-(3-ethoxypropyl)-3-(2-methylpropyl)-1,4-diazaspiro[5.5]undecane
CID 65178246
9-[(5-methyloxolan-2-yl)methyl]-8-(2-methylpropyl)-6,9-diazaspiro[4.5]decane
CID 103141460
3-ethyl-4-(2-methylsulfanylpropyl)-1,4-diazaspiro[5.5]undecane
CID 113466942
8-(2-methylpropyl)-9-(2-thiophen-3-ylethyl)-6,9-diazaspiro[4.5]decane
CID 64876228
8-(2-methylpropyl)-9-(2-phenylmethoxyethyl)-6,9-diazaspiro[4.5]decane
CID 112752388
4-ethyl-3-propyl-1,4-diazaspiro[5.5]undecane
CID 64877421
3-butan-2-yl-4-(3-methylbutyl)-1,4-diazaspiro[5.5]undecane
CID 64877619
4-prop-2-enyl-3-propyl-1,4-diazaspiro[5.5]undecane
CID 64878190

Frequently Asked Questions

What is the IUPAC name of 3,4-bis(2-methylpropyl)-1,4-diazaspiro[5.5]undecane?
The IUPAC name of 3,4-bis(2-methylpropyl)-1,4-diazaspiro[5.5]undecane (CID 64876468) is 3,4-bis(2-methylpropyl)-1,4-diazaspiro[5.5]undecane.
What is the SMILES notation for 3,4-bis(2-methylpropyl)-1,4-diazaspiro[5.5]undecane?
The canonical SMILES for 3,4-bis(2-methylpropyl)-1,4-diazaspiro[5.5]undecane is CC(C)CC1CNC2(CCCCC2)CN1CC(C)C.
What is the InChIKey of 3,4-bis(2-methylpropyl)-1,4-diazaspiro[5.5]undecane?
The InChIKey is AQDLNSHUVHRUDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2/c1-14(2)10-16-11-18-17(8-6-5-7-9-17)13-19(16)12-15(3)4/h14-16,18H,5-13H2,1-4H3.
What are the key properties of 3,4-bis(2-methylpropyl)-1,4-diazaspiro[5.5]undecane?
3,4-bis(2-methylpropyl)-1,4-diazaspiro[5.5]undecane has a molecular weight of 266.47 g/mol, XLogP of 3.67, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-bis(2-methylpropyl)-1,4-diazaspiro[5.5]undecane is sourced from PubChem (CID 64876468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).