Chemical ID: 6341328

CC(C)N(C(C)C)C(=O)c1cccc2c1cccc2
Chemical ID:
6341328
Name [?]:
N,N-diisopropylnaphthalene-1-carboxamide
SMILES [?]:
CC(C)N(C(C)C)C(=O)c1cccc2c1cccc2
InChi [?]:
InChI=1/C17H21NO/c1-12(2)18(13(3)4)17(19)16-11-7-9-14-8-5-6-10-15(14)16/h5-13H,1-4H3
InChi Info:
AuxInfo=1/0/N:1,3,6,7,18,17,12,19,13,16,11,2,5,14,15,10,8,4,9/E:(1,2,3,4)(12,13)/rA:19nCCCNCCCCOCCCCCCCCCC/rB:s1;s2;s2;s4;s5;s5;s4;d8;s8;s10;d11;s12;d13;d10s14;s15;d16;s17;s14d18;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H21NO
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:9.52387
Area:437.835
Solvation:-1.42201
Coulombic:-20.2815
Bond Count [?]
All:20
Single:14
Double:6
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:255.355
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:4.6
LogP (Chemaxon):3.7

Name Annotations

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Descriptor Annotations

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