ethane;6-[(1-methylpiperidin-4-yl)methyl]-2,6-diazaspiro[3.4]octane

C17H37N3 — CID 171641866

IUPACethane;6-[(1-methylpiperidin-4-yl)methyl]-2,6-diazaspiro[3.4]octane
SMILESCC.CC.CN1CCC(CN2CCC3(CNC3)C2)CC1
InChIInChI=1S/C13H25N3.2C2H6/c1-15-5-2-12(3-6-15)8-16-7-4-13(11-16)9-14-10-13;2*1-2/h12,14H,2-11H2,1H3;2*1-2H3
InChIKeyFZJKMFAIIHWVLZ-UHFFFAOYSA-N
MW283.50 g/mol
LogP2.68
Rot. Bonds2

About ethane;6-[(1-methylpiperidin-4-yl)methyl]-2,6-diazaspiro[3.4]octane

ethane;6-[(1-methylpiperidin-4-yl)methyl]-2,6-diazaspiro[3.4]octane (PubChem CID 171641866) has the molecular formula C17H37N3 and a molecular weight of 283.50 g/mol. Its IUPAC name is ethane;6-[(1-methylpiperidin-4-yl)methyl]-2,6-diazaspiro[3.4]octane.

Molecular Properties

Compound Nameethane;6-[(1-methylpiperidin-4-yl)methyl]-2,6-diazaspiro[3.4]octane
PubChem CID171641866
Molecular FormulaC17H37N3
Molecular Weight283.50 g/mol
Exact Mass283.30
IUPAC Nameethane;6-[(1-methylpiperidin-4-yl)methyl]-2,6-diazaspiro[3.4]octane
SMILESCC.CC.CN1CCC(CN2CCC3(CNC3)C2)CC1
InChIInChI=1S/C13H25N3.2C2H6/c1-15-5-2-12(3-6-15)8-16-7-4-13(11-16)9-14-10-13;2*1-2/h12,14H,2-11H2,1H3;2*1-2H3
InChIKeyFZJKMFAIIHWVLZ-UHFFFAOYSA-N
XLogP2.68
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.50
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze ethane;6-[(1-methylpiperidin-4-yl)methyl]-2,6-diazaspiro[3.4]octane 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

6-methyl-2-[(1-methylpiperidin-4-yl)methyl]-2,6-diazaspiro[3.3]heptane
CID 156719594
2-methyl-7-[(1-methylpiperidin-4-yl)methyl]-7-azaspiro[3.5]nonane
CID 167091118
ethane;N-methyl-4-[(7-methyl-2,7-diazaspiro[3.5]nonan-2-yl)methyl]piperidin-1-amine
CID 172630625
ethane;1-[7-[(1-methylpiperidin-4-yl)methyl]-2,7-diazaspiro[3.5]nonan-2-yl]propan-1-one
CID 176968057
8-tert-butyl-2-[(1-tert-butylpiperidin-4-yl)methyl]-2,8-diazaspiro[4.5]decane
CID 146549060
7-[(1-ethylpiperidin-4-yl)methyl]-2-methyl-2,7-diazaspiro[3.5]nonane
CID 171641209
2-methyl-7-[2-(1-methylpiperidin-4-yl)ethyl]-2,7-diazaspiro[3.5]nonane
CID 169319615
9-(cyclopropylmethyl)-2-methyl-2,9-diazaspiro[5.5]undecane
CID 171845215
2-(cyclobutylmethyl)-2,8-diazaspiro[5.5]undecane
CID 102849456
6-methyl-2,6-diazaspiro[3.4]octane;dihydrochloride
CID 122360940
7-methyl-2,7-diazaspiro[3.5]nonane;propane
CID 171103459
7-[[1-(2-methylpentyl)cyclopropyl]methyl]-2-[(1-methylpiperidin-4-yl)methyl]-2,7-diazaspiro[3.5]nonane
CID 174274966

Frequently Asked Questions

What is the IUPAC name of ethane;6-[(1-methylpiperidin-4-yl)methyl]-2,6-diazaspiro[3.4]octane?
The IUPAC name of ethane;6-[(1-methylpiperidin-4-yl)methyl]-2,6-diazaspiro[3.4]octane (CID 171641866) is ethane;6-[(1-methylpiperidin-4-yl)methyl]-2,6-diazaspiro[3.4]octane.
What is the SMILES notation for ethane;6-[(1-methylpiperidin-4-yl)methyl]-2,6-diazaspiro[3.4]octane?
The canonical SMILES for ethane;6-[(1-methylpiperidin-4-yl)methyl]-2,6-diazaspiro[3.4]octane is CC.CC.CN1CCC(CN2CCC3(CNC3)C2)CC1.
What is the InChIKey of ethane;6-[(1-methylpiperidin-4-yl)methyl]-2,6-diazaspiro[3.4]octane?
The InChIKey is FZJKMFAIIHWVLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3.2C2H6/c1-15-5-2-12(3-6-15)8-16-7-4-13(11-16)9-14-10-13;2*1-2/h12,14H,2-11H2,1H3;2*1-2H3.
What are the key properties of ethane;6-[(1-methylpiperidin-4-yl)methyl]-2,6-diazaspiro[3.4]octane?
ethane;6-[(1-methylpiperidin-4-yl)methyl]-2,6-diazaspiro[3.4]octane has a molecular weight of 283.50 g/mol, XLogP of 2.68, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;6-[(1-methylpiperidin-4-yl)methyl]-2,6-diazaspiro[3.4]octane is sourced from PubChem (CID 171641866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).