Chemical ID: 4413705

CCCCN(C)CCCOc1cccc2c1cccc2
Chemical ID:
4413705
Name [?]:
N-methyl-N-[3-(1-naphthyloxy)propyl]butan-1-amine
SMILES [?]:
CCCCN(C)CCCOc1cccc2c1cccc2
InChi [?]:
InChI=1/C18H25NO/c1-3-4-13-19(2)14-8-15-20-18-12-7-10-16-9-5-6-11-17(16)18/h5-7,9-12H,3-4,8,13-15H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,6,2,3,19,18,13,8,20,14,17,12,4,7,9,15,16,11,5,10/rA:20cCCCCNCCCCOCCCCCCCCCC/rB:s1;s2;s3;s4;s5;s5;s7;s8;s9;s10;s11;d12;s13;d14;d11s15;s16;d17;s18;s15d19;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H25NO
All Atoms:20
Heavy Atoms:20
Chiral Atoms:1
ZAP Information [?]
Total:10.4346
Area:515.123
Solvation:-2.44345
Coulombic:-15.6236
Bond Count [?]
All:21
Single:16
Double:5
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:271.397
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:4.76
LogP (Chemaxon):4.03

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