CAS RN: 926622-88-0
(5S)-5-cyclohexyl-2-Pyrrolidinone
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250525 | 1g | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS926622-88-0
- Purity/Analytical Methods: >99.0%
926622-88-0 / 5-cyclohexylpyrrolidin-2-one
Basic Information
CAS
926622-88-0
Multi CAS
Yes
Molecular Formula
C10H17NO
Molecular Weight
167.250000
Exact Mass
167.131014
InChI
InChI=1S/C10H17NO/c12-10-7-6-9(11-10)8-4-2-1-3-5-8/h8-9H,1-7H2,(H,11,12)
InChIKey
RKTJTNMGURCVJM-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
12
Fraction Csp3
0.9
Rotatable bonds
1
H-bond acceptors
1
H-bond donors
1
Molar refractivity
47.74
TPSA
29.1
LogP / Solubility
WLOGP
1.85
MLOGP
1.62
XLogP3
2
Consensus LogP
1.82
Log S (ESOL)
-1.97
Class (ESOL)
Soluble
Log S (Ali)
-2.26
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.4
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.43
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2
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