Chemical ID: 5202795

CC(C(=O)c1ccccc1)N(C)C
Chemical ID:
5202795
Name [?]:
2-dimethylamino-1-phenyl-propan-1-one
SMILES [?]:
CC(C(=O)c1ccccc1)N(C)C
InChi [?]:
InChI=1/C11H15NO/c1-9(12(2)3)11(13)10-7-5-4-6-8-10/h4-9H,1-3H3
InChi Info:
AuxInfo=1/0/N:1,12,13,8,7,9,6,10,2,5,3,11,4/E:(2,3)(5,6)(7,8)/rA:13cCCCOCCCCCCNCC/rB:s1;s2;d3;s3;s5;d6;s7;d8;d5s9;s2;s11;s11;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H15NO
All Atoms:13
Heavy Atoms:13
Chiral Atoms:1
ZAP Information [?]
Total:6.45097
Area:352.708
Solvation:-2.36674
Coulombic:-14.4887
Bond Count [?]
All:13
Single:9
Double:4
Rotors:3
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:177.243
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:1.91
LogP (Chemaxon):1.76

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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