Chemical ID: 6399887

CCCN(CCC)C(=O)Cc1ccccc1
Chemical ID:
6399887
Name [?]:
2-phenyl-N,N-dipropyl-acetamide
SMILES [?]:
CCCN(CCC)C(=O)Cc1ccccc1
InChi [?]:
InChI=1/C14H21NO/c1-3-10-15(11-4-2)14(16)12-13-8-6-5-7-9-13/h5-9H,3-4,10-12H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,7,2,6,14,13,15,12,16,3,5,10,11,8,4,9/E:(1,2)(3,4)(6,7)(8,9)(10,11)/rA:16nCCCNCCCCOCCCCCCC/rB:s1;s2;s3;s4;s5;s6;s4;d8;s8;s10;s11;d12;s13;d14;d11s15;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H21NO
All Atoms:16
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:8.82904
Area:436.916
Solvation:-2.09385
Coulombic:-17.9119
Bond Count [?]
All:16
Single:12
Double:4
Rotors:7
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:219.323
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:2.94
LogP (Chemaxon):2.93

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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