CAS RN: 1429297-48-2

1-piperidin-4-ylpyrazol-4-amine

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Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250619 100mg / 250mg / 1g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS1429297-48-2
  • Purity/Analytical Methods: >99.0%
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1429297-48-2 / 1-piperidin-4-ylpyrazol-4-amine

Standard CAS: 1429297-48-2 Multi CAS: No

Basic Information

CAS
1429297-48-2
Multi CAS
No
Molecular Formula
C8H14N4
Molecular Weight
166.220000
Exact Mass
166.121846
SMILES
C1CNCCC1N2C=C(C=N2)N
InChI
InChI=1S/C8H14N4/c9-7-5-11-12(6-7)8-1-3-10-4-2-8/h5-6,8,10H,1-4,9H2
InChIKey
JPOSFUVFOJECKE-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
5
Fraction Csp3
0.62
Rotatable bonds
1
H-bond acceptors
4
H-bond donors
2
Molar refractivity
47.78
TPSA
55.87

LogP / Solubility

WLOGP
0.39
MLOGP
0.34
XLogP3
-0.4
Consensus LogP
0.11
Log S (ESOL)
-1.36
Class (ESOL)
Soluble
Log S (Ali)
-1.2
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.18
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)
-3.46

Drug-likeness / Medicinal Chemistry

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

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