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CAS 933716-53-1 2-(2-Piperidin-1-ylethoxy)ethylamine molecular structure lightbox
CAS RN: 933716-53-1

2-(2-Piperidin-1-ylethoxy)ethylamine

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251109 100mg / 250mg / 1g Confirm by inquiry Shanghai Inquiry
  • Product code: starshine_CAS933716-53-1
  • Purity/Analytical Methods: >99.0%
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933716-53-1 / 2-(2-piperidin-1-ylethoxy)ethanamine

Standard CAS: 933716-53-1 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
933716-53-1
Multi CAS
No
Molecular Formula
C9H20N2O
Molecular Weight
172.270000
Exact Mass
172.157563
InChI
InChI=1S/C9H20N2O/c10-4-8-12-9-7-11-5-2-1-3-6-11/h1-10H2
InChIKey
WRDVFCGTKXQHPL-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Fraction Csp3
1
Rotatable bonds
5
H-bond acceptors
3
H-bond donors
1
Molar refractivity
50.16
TPSA
38.49

LogP / Solubility

WLOGP
0.45
MLOGP
0.39
XLogP3
0.6
Consensus LogP
0.48
Log S (ESOL)
-0.86
Class (ESOL)
Very soluble
Log S (Ali)
-1.3
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.75
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)
-3.45

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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