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CAS 17202-69-6 Spiro[2.2]pent-1-ylamine molecular structure lightbox
CAS RN: 17202-69-6

Spiro[2.2]pent-1-ylamine

  • Product code: SSC-075678
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 1g
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 17202-69-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Beijing Inquiry

17202-69-6 / spiro[2.2]pentan-2-amine

Standard CAS: 17202-69-6 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
17202-69-6
Multi CAS
No
Molecular Formula
C5H9N
Molecular Weight
83.130000
Exact Mass
83.073499
SMILES
C1CC12CC2N
InChI
InChI=1S/C5H9N/c6-4-3-5(4)1-2-5/h4H,1-3,6H2
InChIKey
TYUSITBZTFHUJR-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
6
Fraction Csp3
1
H-bond acceptors
1
H-bond donors
1
Molar refractivity
24.26
TPSA
26.02

LogP / Solubility

WLOGP
0.5
MLOGP
0.42
XLogP3
0.1
Consensus LogP
0.34
Log S (ESOL)
-0.67
Class (ESOL)
Very soluble
Log S (Ali)
-0.6
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.61
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)
-2.87

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3

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