2-Isopropoxy-4-(4-methylpiperazin-1-yl)aniline - CAS 1280594-97-9
Catalog: |
BB060507 |
Product Name: |
2-Isopropoxy-4-(4-methylpiperazin-1-yl)aniline |
CAS: |
1280594-97-9 |
Synonyms: |
2-Isopropoxy-4-(4-methylpiperazin-1-yl)aniline; 4-(4-methylpiperazin-1-yl)-2-propan-2-yloxyaniline; 4-(4-Methylpiperazin-1-yl)-2-(propan-2-yloxy)aniline; 2-Isopropoxy-4-(4-methyl-1-piperazinyl)aniline |
IUPAC Name: | 4-(4-methylpiperazin-1-yl)-2-propan-2-yloxyaniline |
Description: | 2-Isopropoxy-4-(4-methylpiperazin-1-yl)aniline |
Molecular Weight: | 249.35 |
Molecular Formula: | C14H23N3O |
Canonical SMILES: | CC(C)OC1=C(C=CC(=C1)N2CCN(CC2)C)N |
InChI: | InChI=1S/C14H23N3O/c1-11(2)18-14-10-12(4-5-13(14)15)17-8-6-16(3)7-9-17/h4-5,10-11H,6-9,15H2,1-3H3 |
InChI Key: | IRGBROWUJHZCIN-UHFFFAOYSA-N |
Complexity: | 251 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 249.184112366 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 249.184112366 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 41.7Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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