![CAS 1185319-44-1 5′-Methyl-3,4,5,6-tetrahydro-2H-[1,2′]bipyridinyl-4-ylaMine hydrochloride, 98+% C11H18ClN3, MW: 227.73 molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1185319-44-1.gif)
CAS RN: 1185319-44-1
5′-Methyl-3,4,5,6-tetrahydro-2H-[1,2′]bipyridinyl-4-ylaMine hydrochloride, 98+% C11H18ClN3, MW: 227.73
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.20250909 | 500mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS1185319-44-1
- Purity/Analytical Methods: >99.0%
1185319-44-1 / 1-(5-methyl-2-pyridinyl)piperidin-4-amine;hydrochloride
1-(5-Methylpyridin-2-yl)piperidin-4-amine hydrochloride | 5'-Methyl-3,4,5,6-tetrahydro-2H-[1,2']bipyridinyl-4-ylamine hydrochloride | 1-(5-methylpyridin-2-yl)piperidin-4-amine;hydrochloride
Basic Information
CAS
1185319-44-1
Multi CAS
Yes
Molecular Formula
C11H18ClN3
Molecular Weight
227.730000
Exact Mass
227.118925
SMILES
CC1=CN=C(C=C1)N2CCC(CC2)N.Cl
InChI
InChI=1S/C11H17N3.ClH/c1-9-2-3-11(13-8-9)14-6-4-10(12)5-7-14;/h2-3,8,10H,4-7,12H2,1H3;1H
InChIKey
QPUCXSMBALVBJH-UHFFFAOYSA-N
Synonyms
1-(5-Methylpyridin-2-yl)piperidin-4-amine hydrochloride
5'-Methyl-3,4,5,6-tetrahydro-2H-[1,2']bipyridinyl-4-ylamine hydrochloride
1-(5-methylpyridin-2-yl)piperidin-4-amine;hydrochloride
DTXSID80671510
SBB074914
Computed Properties
Structural Parameters
Heavy atom count
15
Aromatic heavy atom count
6
Fraction Csp3
0.55
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
1
Molar refractivity
65.64
TPSA
42.15
LogP / Solubility
WLOGP
1.74
MLOGP
1.53
XLogP3
1.74
Consensus LogP
1.67
Log S (ESOL)
-2.58
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.68
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.7
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)
-2.87
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
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