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CAS 62430-05-1 (5S)5-(2-Methylpropyl)-2-Pyrrolidinone molecular structure lightbox
CAS RN: 62430-05-1

(5S)5-(2-Methylpropyl)-2-Pyrrolidinone

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250401 200mg Out of stock 15 business days Inquiry
  • Product code: starshine_CAS62430-05-1
  • Purity/Analytical Methods: >99.0%
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62430-05-1 / 5-(2-methylpropyl)pyrrolidin-2-one

Standard CAS: 62430-05-1 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
62430-05-1
Multi CAS
Yes
Molecular Formula
C8H15NO
Molecular Weight
141.210000
Exact Mass
141.115364
InChI
InChI=1S/C8H15NO/c1-6(2)5-7-3-4-8(10)9-7/h6-7H,3-5H2,1-2H3,(H,9,10)/t7-/m0/s1
InChIKey
SRTMHYDFTGFOIE-ZETCQYMHSA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Fraction Csp3
0.88
Rotatable bonds
2
H-bond acceptors
1
H-bond donors
1
Molar refractivity
40.62
TPSA
29.1

LogP / Solubility

WLOGP
1.31
MLOGP
1.15
XLogP3
1.4
Consensus LogP
1.29
Log S (ESOL)
-1.41
Class (ESOL)
Soluble
Log S (Ali)
-1.66
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.91
Class (SILICOS-IT)
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)
-2.65

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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