actinium;2-(2-hydroxyethyl)cyclododecan-1-one

C14H26AcO2 — CID 20650069

IUPACactinium;2-(2-hydroxyethyl)cyclododecan-1-one
SMILESO=C1CCCCCCCCCCC1CCO.[Ac]
InChIInChI=1S/C14H26O2.Ac/c15-12-11-13-9-7-5-3-1-2-4-6-8-10-14(13)16;/h13,15H,1-12H2;
InChIKeyASDUOPNLPITYMC-UHFFFAOYSA-N
MW453.36 g/mol
LogP3.47
Rot. Bonds2

About actinium;2-(2-hydroxyethyl)cyclododecan-1-one

actinium;2-(2-hydroxyethyl)cyclododecan-1-one (PubChem CID 20650069) has the molecular formula C14H26AcO2 and a molecular weight of 453.36 g/mol. Its IUPAC name is actinium;2-(2-hydroxyethyl)cyclododecan-1-one.

Molecular Properties

Compound Nameactinium;2-(2-hydroxyethyl)cyclododecan-1-one
PubChem CID20650069
Molecular FormulaC14H26AcO2
Molecular Weight453.36 g/mol
Exact Mass453.22
IUPAC Nameactinium;2-(2-hydroxyethyl)cyclododecan-1-one
SMILESO=C1CCCCCCCCCCC1CCO.[Ac]
InChIInChI=1S/C14H26O2.Ac/c15-12-11-13-9-7-5-3-1-2-4-6-8-10-14(13)16;/h13,15H,1-12H2;
InChIKeyASDUOPNLPITYMC-UHFFFAOYSA-N
XLogP3.47
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500453.36
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze actinium;2-(2-hydroxyethyl)cyclododecan-1-one 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-(Hydroxymethyl)-2-octanone
CID 62148
Serricornin
CID 194454
2-Nonanone, 3-(hydroxymethyl)-
CID 106823
6-Dodecanone, 5,8-diethyl-7-hydroxy-
CID 169366
Cyclopentanone, 2-(1-hydroxyheptyl)-
CID 11008912
6-Hydroxy-3,7-dimethyloctanoic acid
CID 23422948
2-(3-Hydroxypropyl)cyclododecanone
CID 10130987
2-(3-Hydroxypropyl)cyclohexan-1-one
CID 12244234
3-Hydroxy-2-methyltridecan-4-one
CID 57398496
8-Acetyl-12-hydroxydodecanoic acid
CID 71400118
6-Undecanone, 1,11-dihydroxy-2,2,10,10-tetramethyl-
CID 9899878
9-Hydroxy-3-(6-hydroxy-5,5-dimethylhexyl)-8,8-dimethylnonan-2-one
CID 11638232

Frequently Asked Questions

What is the IUPAC name of actinium;2-(2-hydroxyethyl)cyclododecan-1-one?
The IUPAC name of actinium;2-(2-hydroxyethyl)cyclododecan-1-one (CID 20650069) is actinium;2-(2-hydroxyethyl)cyclododecan-1-one.
What is the SMILES notation for actinium;2-(2-hydroxyethyl)cyclododecan-1-one?
The canonical SMILES for actinium;2-(2-hydroxyethyl)cyclododecan-1-one is O=C1CCCCCCCCCCC1CCO.[Ac].
What is the InChIKey of actinium;2-(2-hydroxyethyl)cyclododecan-1-one?
The InChIKey is ASDUOPNLPITYMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26O2.Ac/c15-12-11-13-9-7-5-3-1-2-4-6-8-10-14(13)16;/h13,15H,1-12H2;.
What are the key properties of actinium;2-(2-hydroxyethyl)cyclododecan-1-one?
actinium;2-(2-hydroxyethyl)cyclododecan-1-one has a molecular weight of 453.36 g/mol, XLogP of 3.47, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for actinium;2-(2-hydroxyethyl)cyclododecan-1-one is sourced from PubChem (CID 20650069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).