ChemDB: Chemical Search
Download
Chemical ID: 4953238
Chemical ID:
4953238
Name [?]:
2-(2-methoxyphenyl)propan-1-amine
SMILES [?]:
CC(CN)c1ccccc1OC
InChi [?]:
InChI=1/C10H15NO/c1-8(7-11)9-5-3-4-6-10(9)12-2/h3-6,8H,7,11H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,12,7,8,6,9,3,2,5,10,4,11/rA:12cCCCNCCCCCCOC/rB:s1;s2;s3;s2;s5;d6;s7;d8;d5s9;s10;s11;/rC:;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C10H15NO |
All Atoms: | 12 |
Heavy Atoms: | 12 |
Chiral Atoms: | 1 |
ZAP Information [?]
Total: | 6.26777 |
Area: | 340.005 |
Solvation: | -2.23236 |
Coulombic: | -20.9412 |
Bond Count [?]
All: | 12 |
Single: | 9 |
Double: | 3 |
Rotors: | 3 |
Chiral: | 0 |
Rigid Segments: | 4 |
Chemical Properties
Molecular Weight: | 165.232 |
H-Bond Donors: | 2 |
H-Bond Acceptors: | 2 |
XLogP: | 1.51 |
LogP (Chemaxon): | 1.57 |
Name Annotations
Note: All annotations are abbreviated. For more detailed information please download chemical.
Chemical | Mix Source | External ID | Descriptor | Value |
---|
Experimental Annotations
Note: All annotations are abbreviated. For more detailed information please download chemical.
Chemical Mix | Source | External ID | Descriptor | Value |
---|
Descriptor Annotations
Note: All annotations are abbreviated. For more detailed information please download chemical.
Chemical Mix | Source | External ID | Descriptor | Value |
---|