7-(6-ethyl-2,6-diazaspiro[3.3]heptan-2-yl)heptan-1-ol

C14H28N2O — CID 171637866

IUPAC7-(6-ethyl-2,6-diazaspiro[3.3]heptan-2-yl)heptan-1-ol
SMILESCCN1CC2(C1)CN(CCCCCCCO)C2
InChIInChI=1S/C14H28N2O/c1-2-15-10-14(11-15)12-16(13-14)8-6-4-3-5-7-9-17/h17H,2-13H2,1H3
InChIKeyIJKAVROWPRKKFJ-UHFFFAOYSA-N
MW240.39 g/mol
LogP1.57
Rot. Bonds8

About 7-(6-ethyl-2,6-diazaspiro[3.3]heptan-2-yl)heptan-1-ol

7-(6-ethyl-2,6-diazaspiro[3.3]heptan-2-yl)heptan-1-ol (PubChem CID 171637866) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 7-(6-ethyl-2,6-diazaspiro[3.3]heptan-2-yl)heptan-1-ol.

Molecular Properties

Compound Name7-(6-ethyl-2,6-diazaspiro[3.3]heptan-2-yl)heptan-1-ol
PubChem CID171637866
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name7-(6-ethyl-2,6-diazaspiro[3.3]heptan-2-yl)heptan-1-ol
SMILESCCN1CC2(C1)CN(CCCCCCCO)C2
InChIInChI=1S/C14H28N2O/c1-2-15-10-14(11-15)12-16(13-14)8-6-4-3-5-7-9-17/h17H,2-13H2,1H3
InChIKeyIJKAVROWPRKKFJ-UHFFFAOYSA-N
XLogP1.57
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 7-(6-ethyl-2,6-diazaspiro[3.3]heptan-2-yl)heptan-1-ol 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

ethane;7-(6-ethyl-2,6-diazaspiro[3.3]heptan-2-yl)heptan-1-ol;vanadium
CID 171637865
5-(3,3-dimethylazetidin-1-yl)pentan-1-ol
CID 107319640
5-(3,3-dipropylazetidin-1-yl)pentan-1-ol
CID 107319611
6-(7-oxa-2-azaspiro[3.5]nonan-2-yl)hexan-1-ol
CID 107849721
4-(2,2,6,6-tetramethylmorpholin-4-yl)butan-1-ol
CID 102745117
10-(4-methylpiperazin-1-yl)decan-1-ol;12-(4-methylpiperazin-1-yl)dodecan-1-ol
CID 22218533
ethane;2-ethyl-7-pentyl-2,7-diazaspiro[3.5]nonane
CID 171554465
2-(3-hydroxypropyl)-2-azaspiro[3.3]heptan-6-ol
CID 166894539
6-(4-propan-2-ylpiperidin-1-yl)hexan-1-ol
CID 103738002
10-piperidin-1-yldecan-1-ol
CID 22218518
6-(azacyclotridec-1-yl)hexan-1-ol
CID 101161993
3-(5-azaspiro[2.4]heptan-5-yl)propan-1-ol
CID 16736944

Frequently Asked Questions

What is the IUPAC name of 7-(6-ethyl-2,6-diazaspiro[3.3]heptan-2-yl)heptan-1-ol?
The IUPAC name of 7-(6-ethyl-2,6-diazaspiro[3.3]heptan-2-yl)heptan-1-ol (CID 171637866) is 7-(6-ethyl-2,6-diazaspiro[3.3]heptan-2-yl)heptan-1-ol.
What is the SMILES notation for 7-(6-ethyl-2,6-diazaspiro[3.3]heptan-2-yl)heptan-1-ol?
The canonical SMILES for 7-(6-ethyl-2,6-diazaspiro[3.3]heptan-2-yl)heptan-1-ol is CCN1CC2(C1)CN(CCCCCCCO)C2.
What is the InChIKey of 7-(6-ethyl-2,6-diazaspiro[3.3]heptan-2-yl)heptan-1-ol?
The InChIKey is IJKAVROWPRKKFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-2-15-10-14(11-15)12-16(13-14)8-6-4-3-5-7-9-17/h17H,2-13H2,1H3.
What are the key properties of 7-(6-ethyl-2,6-diazaspiro[3.3]heptan-2-yl)heptan-1-ol?
7-(6-ethyl-2,6-diazaspiro[3.3]heptan-2-yl)heptan-1-ol has a molecular weight of 240.39 g/mol, XLogP of 1.57, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(6-ethyl-2,6-diazaspiro[3.3]heptan-2-yl)heptan-1-ol is sourced from PubChem (CID 171637866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).