3-Amino-1-methylpyridin-2(1H)-one - CAS 33631-01-5
Catalog: |
BB021802 |
Product Name: |
3-Amino-1-methylpyridin-2(1H)-one |
CAS: |
33631-01-5 |
Synonyms: |
3-amino-1-methyl-2-pyridinone; 3-amino-1-methylpyridin-2-one |
IUPAC Name: | 3-amino-1-methylpyridin-2-one |
Description: | 3-Amino-1-methylpyridin-2(1H)-one (CAS# 33631-01-5) is a useful research chemical. |
Molecular Weight: | 124.14 |
Molecular Formula: | C6H8N2O |
Canonical SMILES: | CN1C=CC=C(C1=O)N |
InChI: | InChI=1S/C6H8N2O/c1-8-4-2-3-5(7)6(8)9/h2-4H,7H2,1H3 |
InChI Key: | IHSBTHXDCVIBPF-UHFFFAOYSA-N |
Boiling Point: | 296 °C at 760 mmHg |
Density: | 1.169 g/cm3 |
Appearance: | Dark brown powder |
MDL: | MFCD12402373 |
LogP: | 0.54870 |
GHS Hazard Statement: | H302 (100%): 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-2021071843-A1 | Muscarinic acetylcholine m1 receptor antagonists | 20191007 |
WO-2020263967-A1 | 2h-indazole derivatives and their use in the treatment of disease | 20190627 |
WO-2020263980-A1 | Imidazo[1,2-a]pyridinyl derivatives and their use in the treatment of disease | 20190627 |
US-10562906-B2 | TYK2 inhibitors and uses thereof | 20170728 |
US-10562907-B2 | TYK2 inhibitors and uses thereof | 20170728 |
Complexity: | 193 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 124.063662883 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 124.063662883 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 46.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.1 |
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Related Functional Groups
Amines and Anilines
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