(1S,6R)-tricyclo[4.3.1.01,6]decan-7-one

C10H14O — CID 13167045

IUPAC(1S,6R)-tricyclo[4.3.1.01,6]decan-7-one
SMILESO=C1CC[C@]23CCCC[C@]12C3
InChIInChI=1S/C10H14O/c11-8-3-6-9-4-1-2-5-10(8,9)7-9/h1-7H2/t9-,10-/m0/s1
InChIKeyZZHOIPXKSGRVSS-UWVGGRQHSA-N
MW150.22 g/mol
LogP2.30
Rot. Bonds

About (1S,6R)-tricyclo[4.3.1.01,6]decan-7-one

(1S,6R)-tricyclo[4.3.1.01,6]decan-7-one (PubChem CID 13167045) has the molecular formula C10H14O and a molecular weight of 150.22 g/mol. Its IUPAC name is (1S,6R)-tricyclo[4.3.1.01,6]decan-7-one.

Molecular Properties

Compound Name(1S,6R)-tricyclo[4.3.1.01,6]decan-7-one
PubChem CID13167045
Molecular FormulaC10H14O
Molecular Weight150.22 g/mol
Exact Mass150.10
IUPAC Name(1S,6R)-tricyclo[4.3.1.01,6]decan-7-one
SMILESO=C1CC[C@]23CCCC[C@]12C3
InChIInChI=1S/C10H14O/c11-8-3-6-9-4-1-2-5-10(8,9)7-9/h1-7H2/t9-,10-/m0/s1
InChIKeyZZHOIPXKSGRVSS-UWVGGRQHSA-N
XLogP2.30
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze (1S,6R)-tricyclo[4.3.1.01,6]decan-7-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

(1R,7S)-tricyclo[5.3.1.01,7]undecan-8-one
CID 13167047
(1R,6R)-tricyclo[4.4.1.01,6]undecane-2,7-dione
CID 130765311
dispiro[2.0.34.43]undecan-11-one
CID 121217052
10-methylidenetricyclo[4.3.2.01,6]undecan-7-one
CID 130030751
tricyclo[3.3.2.01,5]decan-9-one
CID 12564319
trispiro[3.0.0.46.25.24]tetradecan-11-one
CID 23727770
(5R)-trispiro[3.0.0.46.25.24]tetradecan-11-one
CID 23727846
(6R,9S)-9-(2-hydroxypropan-2-yl)tricyclo[4.4.1.01,6]undecan-2-one
CID 11969863
10-ethenyl-10-hydroxyspiro[4.5]decan-6-one
CID 155931172
13-oxadispiro[4.0.66.25]tetradecan-14-one
CID 10465651
2,2-dimethylspiro[2.4]heptan-1-one
CID 130031044
6,9,13,16-tetrazaspiro[3.13]heptadecan-3-one
CID 101251967

Frequently Asked Questions

What is the IUPAC name of (1S,6R)-tricyclo[4.3.1.01,6]decan-7-one?
The IUPAC name of (1S,6R)-tricyclo[4.3.1.01,6]decan-7-one (CID 13167045) is (1S,6R)-tricyclo[4.3.1.01,6]decan-7-one.
What is the SMILES notation for (1S,6R)-tricyclo[4.3.1.01,6]decan-7-one?
The canonical SMILES for (1S,6R)-tricyclo[4.3.1.01,6]decan-7-one is O=C1CC[C@]23CCCC[C@]12C3.
What is the InChIKey of (1S,6R)-tricyclo[4.3.1.01,6]decan-7-one?
The InChIKey is ZZHOIPXKSGRVSS-UWVGGRQHSA-N. The full InChI is InChI=1S/C10H14O/c11-8-3-6-9-4-1-2-5-10(8,9)7-9/h1-7H2/t9-,10-/m0/s1.
What are the key properties of (1S,6R)-tricyclo[4.3.1.01,6]decan-7-one?
(1S,6R)-tricyclo[4.3.1.01,6]decan-7-one has a molecular weight of 150.22 g/mol, XLogP of 2.30, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1S,6R)-tricyclo[4.3.1.01,6]decan-7-one is sourced from PubChem (CID 13167045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).