CAS RN: 1314354-59-0
5-(piperidin-1-yl)pyrazin-2-aMine, 97%(HPLC)
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250329 | 200mg | Out of stock | 5-7 business days | Inquiry |
- Product code: LINM927181
1314354-59-0 / 5-piperidin-1-ylpyrazin-2-amine
Basic Information
CAS
1314354-59-0
Multi CAS
No
Molecular Formula
C9H14N4
Molecular Weight
178.230000
Exact Mass
178.121846
SMILES
C1CCN(CC1)C2=NC=C(N=C2)N
InChI
InChI=1S/C9H14N4/c10-8-6-12-9(7-11-8)13-4-2-1-3-5-13/h6-7H,1-5H2,(H2,10,11)
InChIKey
PKFUFKBRKILJEZ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
13
Aromatic heavy atom count
6
Fraction Csp3
0.56
Rotatable bonds
1
H-bond acceptors
4
H-bond donors
1
Molar refractivity
52.51
TPSA
55.04
LogP / Solubility
WLOGP
1.05
MLOGP
0.92
XLogP3
0.7
Consensus LogP
0.89
Log S (ESOL)
-1.88
Class (ESOL)
Soluble
Log S (Ali)
-1.78
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.81
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)
-3.06
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
