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CAS 4736-71-4 PYRROLIDINE-1-CARBOXYLIC ACID AMIDE molecular structure lightbox
CAS RN: 4736-71-4

PYRROLIDINE-1-CARBOXYLIC ACID AMIDE

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250825 100mg / 250mg / 1g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS4736-71-4
  • Purity/Analytical Methods: >99.0%
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4736-71-4 / pyrrolidine-1-carboxamide

Standard CAS: 4736-71-4 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
4736-71-4
Multi CAS
No
Molecular Formula
C5H10N2O
Molecular Weight
114.150000
Exact Mass
114.079313
InChI
InChI=1S/C5H10N2O/c6-5(8)7-3-1-2-4-7/h1-4H2,(H2,6,8)
InChIKey
LCDCPQHFCOBUEF-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
8
Fraction Csp3
0.8
H-bond acceptors
1
H-bond donors
1
Molar refractivity
30.39
TPSA
46.33

LogP / Solubility

WLOGP
0.16
MLOGP
0.13
XLogP3
-0.2
Consensus LogP
0.03
Log S (ESOL)
-0.65
Class (ESOL)
Very soluble
Log S (Ali)
-0.61
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.54
Class (SILICOS-IT)
Very 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)
-3.3

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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