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CAS 877125-98-9 7-AMINOMETHYL-SPIRO[3.5]NONANE molecular structure lightbox
CAS RN: 877125-98-9

7-AMINOMETHYL-SPIRO[3.5]NONANE

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250317 250mg / 1g Out of stock 15 business days Inquiry
  • Product code: starshine_CAS877125-98-9
  • Purity/Analytical Methods: >99.0%
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877125-98-9 / spiro[3.5]nonan-7-ylmethanamine

Standard CAS: 877125-98-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
877125-98-9
Multi CAS
No
Molecular Formula
C10H19N
Molecular Weight
153.260000
Exact Mass
153.151750
InChI
InChI=1S/C10H19N/c11-8-9-2-6-10(7-3-9)4-1-5-10/h9H,1-8,11H2
InChIKey
OPYDFKJFDKKDIO-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Fraction Csp3
1
Rotatable bonds
1
H-bond acceptors
1
H-bond donors
1
Molar refractivity
47.3
TPSA
26.02

LogP / Solubility

WLOGP
2.31
MLOGP
2.02
XLogP3
2.6
Consensus LogP
2.31
Log S (ESOL)
-2.18
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.48
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.69
Class (SILICOS-IT)
Moderately 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)
-2.02

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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