2-[1-(Boc-amino)cyclopropyl]pyridine - CAS 873221-80-8
Catalog: |
BB038373 |
Product Name: |
2-[1-(Boc-amino)cyclopropyl]pyridine |
CAS: |
873221-80-8 |
Synonyms: |
N-[1-(2-pyridinyl)cyclopropyl]carbamic acid tert-butyl ester; tert-butyl N-(1-pyridin-2-ylcyclopropyl)carbamate |
IUPAC Name: | tert-butyl N-(1-pyridin-2-ylcyclopropyl)carbamate |
Description: | 2-[1-(Boc-amino)cyclopropyl]pyridine (CAS# 873221-80-8) is a useful research chemical. |
Molecular Weight: | 234.29 |
Molecular Formula: | C13H18N2O2 |
Canonical SMILES: | CC(C)(C)OC(=O)NC1(CC1)C2=CC=CC=N2 |
InChI: | InChI=1S/C13H18N2O2/c1-12(2,3)17-11(16)15-13(7-8-13)10-6-4-5-9-14-10/h4-6,9H,7-8H2,1-3H3,(H,15,16) |
InChI Key: | SJMCLXGSTZURGK-UHFFFAOYSA-N |
LogP: | 2.79980 |
Publication Number | Title | Priority Date |
JP-WO2006014005-A1 | Pyrazole derivative | 20040806 |
KR-20070048771-A | Pyrazole derivatives | 20040806 |
AU-2005258397-A1 | Pyrazole derivatives | 20040701 |
CA-2572163-A1 | Pyrazole derivatives | 20040701 |
EP-1762568-A1 | Pyrazole derivatives | 20040701 |
Complexity: | 292 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 234.136827821 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 234.136827821 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 51.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.7 |
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