(R)-3-N-Boc-aminomethyl pyrrolidine - CAS 173340-25-5
Catalog: |
BB012913 |
Product Name: |
(R)-3-N-Boc-aminomethyl pyrrolidine |
CAS: |
173340-25-5 |
Synonyms: |
N-[[(3R)-3-pyrrolidinyl]methyl]carbamic acid tert-butyl ester; tert-butyl N-[[(3R)-pyrrolidin-3-yl]methyl]carbamate |
IUPAC Name: | tert-butyl N-[[(3R)-pyrrolidin-3-yl]methyl]carbamate |
Description: | (R)-3-N-Boc-aminomethyl pyrrolidine (CAS# 173340-25-5) is a useful reagent in the research discovery of ethyl 5,6-dihydropyrazolo[1,5-c]quinazoline-1-carboxylate, a catalytic inhibitor of DNA gyrase and a potential antibacterial agent. |
Molecular Weight: | 200.28 |
Molecular Formula: | C10H20N2O2 |
Canonical SMILES: | CC(C)(C)OC(=O)NCC1CCNC1 |
InChI: | InChI=1S/C10H20N2O2/c1-10(2,3)14-9(13)12-7-8-4-5-11-6-8/h8,11H,4-7H2,1-3H3,(H,12,13)/t8-/m1/s1 |
InChI Key: | WIEJVMZWPIUWHO-MRVPVSSYSA-N |
Boiling Point: | 303.9 °C at 760 mmHg |
Density: | 0.997 g/cm3 |
Appearance: | Solid |
LogP: | 1.84030 |
GHS Hazard Statement: | H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021097061-A1 | Antimicrobial compounds and methods | 20191113 |
WO-2020252222-A1 | Progranulin modulators and methods of using the same | 20190612 |
WO-2020227168-A1 | Inhibiting trabid | 20190503 |
WO-2020150372-A1 | Antimicrobial compounds and methods | 20190116 |
WO-2020150385-A1 | Antimicrobial compounds and methods | 20190116 |
Complexity: | 199 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 1 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 200.152477885 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 200.152477885 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 50.4 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.9 |
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Pyrrolidines
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