CAS RN: 89451-59-2

(2R,4R)-2-Methylpiperidin-4-ol

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Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260318 100mg / 250mg Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS89451-59-2
  • Purity/Analytical Methods: >99.0%
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89451-59-2 / (2R,4R)-2-methylpiperidin-4-ol

Standard CAS: 89451-59-2 Multi CAS: Yes

Basic Information

CAS
89451-59-2
Multi CAS
Yes
Molecular Formula
C6H13NO
Molecular Weight
115.170000
Exact Mass
115.099714
InChI
InChI=1S/C6H13NO/c1-5-4-6(8)2-3-7-5/h5-8H,2-4H2,1H3/t5-,6-/m1/s1
InChIKey
DSVHVLZINDRYQA-PHDIDXHHSA-N

Computed Properties

Structural Parameters

Heavy atom count
8
Fraction Csp3
1
H-bond acceptors
2
H-bond donors
2
Molar refractivity
32.71
TPSA
32.26

LogP / Solubility

WLOGP
0.12
MLOGP
0.09
XLogP3
0.1
Consensus LogP
0.1
Log S (ESOL)
-0.63
Class (ESOL)
Very soluble
Log S (Ali)
-0.59
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.51
Class (SILICOS-IT)
Very 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)
-3.34

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5

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