Chemical ID: 4286221

CCN(CC)CCCCCCOc1ccc2ccccc2c1
Chemical ID:
4286221
Name [?]:
N,N-diethyl-6-(2-naphthyloxy)hexan-1-amine
SMILES [?]:
CCN(CC)CCCCCCOc1ccc2ccccc2c1
InChi [?]:
InChI=1/C20H29NO/c1-3-21(4-2)15-9-5-6-10-16-22-20-14-13-18-11-7-8-12-19(18)17-20/h7-8,11-14,17H,3-6,9-10,15-16H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,5,2,4,8,9,18,19,7,10,17,20,15,14,6,11,22,16,21,13,3,12/E:(1,2)(3,4)/rA:22nCCNCCCCCCCCOCCCCCCCCCC/rB:s1;s2;s3;s4;s3;s6;s7;s8;s9;s10;s11;s12;s13;d14;s15;s16;d17;s18;d19;d16s20;d13s21;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H29NO
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:11.6658
Area:565.114
Solvation:-2.46206
Coulombic:-15.597
Bond Count [?]
All:23
Single:18
Double:5
Rotors:10
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:299.45
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:5.33
LogP (Chemaxon):4.76

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Descriptor Annotations

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