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CAS 59983-39-0 (S)-(-)-1-Amino-2-(methoxymethyl)pyrrolidine molecular structure lightbox
CAS RN: 59983-39-0

(S)-(-)-1-Amino-2-(methoxymethyl)pyrrolidine

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251026 50mg / 200mg / 1g / 5g Confirm by inquiry Shanghai, Shandong Inquiry
  • Product code: ICTA1335
  • Purity/Analytical Methods: >98.0%(T)
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59983-39-0 / 2-(methoxymethyl)pyrrolidin-1-amine

Standard CAS: 59983-39-0 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
59983-39-0
Multi CAS
Yes
Molecular Formula
C6H14N2O
Molecular Weight
130.190000
Exact Mass
130.110613
InChI
InChI=1S/C6H14N2O/c1-9-5-6-3-2-4-8(6)7/h6H,2-5,7H2,1H3
InChIKey
BWSIKGOGLDNQBZ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
9
Fraction Csp3
1
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
1
Molar refractivity
35.79
TPSA
38.49

LogP / Solubility

WLOGP
-0.03
MLOGP
-0.03
XLogP3
-0.1
Consensus LogP
-0.05
Log S (ESOL)
-0.5
Class (ESOL)
Very soluble
Log S (Ali)
-0.61
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.72
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)
-3.53

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
2

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