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CAS 1187929-51-6 (R)-1-Isopropyl-2-methyl-piperazine molecular structure lightbox
CAS RN: 1187929-51-6

(R)-1-Isopropyl-2-methyl-piperazine

  • Product code: SSC-018818
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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 1187929-51-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Beijing Inquiry

1187929-51-6 / (2R)-2-methyl-1-propan-2-ylpiperazine

2-Methyl-1-(propan-2-yl)piperazine | DTXSID70590468 | RefChem:262954

Standard CAS: 1187929-51-6 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
1187929-51-6
Multi CAS
Yes
Molecular Formula
C8H18N2
Molecular Weight
142.240000
Exact Mass
142.146999
SMILES
C[C@@H]1CNCCN1C(C)C
InChI
InChI=1S/C8H18N2/c1-7(2)10-5-4-9-6-8(10)3/h7-9H,4-6H2,1-3H3/t8-/m1/s1
InChIKey
GGROKFCODOVWLX-MRVPVSSYSA-N
Synonyms
2-Methyl-1-(propan-2-yl)piperazine DTXSID70590468 RefChem:262954 DTXCID10541232 1-isopropyl-2-methylpiperazine

Computed Properties

Structural Parameters

Heavy atom count
10
Fraction Csp3
1
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
1
Molar refractivity
44.17
TPSA
15.27

LogP / Solubility

WLOGP
0.69
MLOGP
0.6
XLogP3
0.8
Consensus LogP
0.7
Log S (ESOL)
-1.09
Class (ESOL)
Soluble
Log S (Ali)
-1.22
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.28
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)
-3.1

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2

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