Chemical ID: 4905602

CCN(CC)CC(=O)Nc1ccccc1C
Chemical ID:
4905602
Name [?]:
2-diethylamino-N-(o-tolyl)acetamide
SMILES [?]:
CCN(CC)CC(=O)Nc1ccccc1C
InChi [?]:
InChI=1/C13H20N2O/c1-4-15(5-2)10-13(16)14-12-9-7-6-8-11(12)3/h6-9H,4-5,10H2,1-3H3,(H,14,16)
InChi Info:
AuxInfo=1/1/N:1,5,16,2,4,13,12,14,11,6,15,10,7,9,3,8/E:(1,2)(4,5)/rA:16nCCNCCCCONCCCCCCC/rB:s1;s2;s3;s4;s3;s6;d7;s7;s9;s10;d11;s12;d13;d10s14;s15;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H20N2O
All Atoms:16
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:8.06647
Area:423.573
Solvation:-2.52285
Coulombic:-25.9727
Bond Count [?]
All:16
Single:12
Double:4
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:220.311
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:1.87
LogP (Chemaxon):1.74

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Descriptor Annotations

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