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CAS 1173069-63-0 1-(2-Piperidin-1-ylethyl)-1H-pyrazol-4-amine dihydrochloride molecular structure lightbox
CAS RN: 1173069-63-0

1-(2-Piperidin-1-ylethyl)-1H-pyrazol-4-amine dihydrochloride

  • Product code: SSC-017169
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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 1173069-63-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shanghai Inquiry

1173069-63-0 / 1-(2-piperidin-1-ylethyl)pyrazol-4-amine

1-(2-(piperidin-1-yl)ethyl)-1h-pyrazol-4-amine | 1-[2-(piperidin-1-yl)ethyl]-1H-pyrazol-4-amine | 1-(2-piperidin-1-ylethyl)pyrazol-4-amine

Standard CAS: 1173069-63-0 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
1173069-63-0
Multi CAS
Yes
Molecular Formula
C10H18N4
Molecular Weight
194.280000
Exact Mass
194.153147
SMILES
C1CCN(CC1)CCN2C=C(C=N2)N
InChI
InChI=1S/C10H18N4/c11-10-8-12-14(9-10)7-6-13-4-2-1-3-5-13/h8-9H,1-7,11H2
InChIKey
GPRKMRZDNYXLKF-UHFFFAOYSA-N
Synonyms
1-(2-(piperidin-1-yl)ethyl)-1h-pyrazol-4-amine 1-[2-(piperidin-1-yl)ethyl]-1H-pyrazol-4-amine 1-(2-piperidin-1-ylethyl)pyrazol-4-amine 1-[2-(1-Piperidinyl)ethyl]-1H-pyrazol-4-amine MFCD09965620

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
5
Fraction Csp3
0.7
Rotatable bonds
3
H-bond acceptors
4
H-bond donors
1
Molar refractivity
56.93
TPSA
47.08

LogP / Solubility

WLOGP
0.95
MLOGP
0.84
XLogP3
0.4
Consensus LogP
0.73
Log S (ESOL)
-1.71
Class (ESOL)
Soluble
Log S (Ali)
-1.84
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.07
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)
-3.23

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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