Chemical ID: 4947587

COCCCNc1c2ccccc2nc3c1cccc3
Chemical ID:
4947587
Name [?]:
N-(3-methoxypropyl)acridin-9-amine
SMILES [?]:
COCCCNc1c2ccccc2nc3c1cccc3
InChi [?]:
InChI=1/C17H18N2O/c1-20-12-6-11-18-17-13-7-2-4-9-15(13)19-16-10-5-3-8-14(16)17/h2-5,7-10H,6,11-12H2,1H3,(H,18,19)
InChi Info:
AuxInfo=1/1/N:1,10,18,11,19,4,9,17,12,20,5,3,8,16,13,15,7,6,14,2/E:(2,3)(4,5)(7,8)(9,10)(13,14)(15,16)/rA:20nCOCCCNCCCCCCCNCCCCCC/rB:s1;s2;s3;s4;s5;s6;s7;s8;d9;s10;d11;d8s12;s13;d14;d7s15;s16;d17;s18;s15d19;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H18N2O
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:8.64082
Area:470.786
Solvation:-3.12883
Coulombic:-26.715
Bond Count [?]
All:22
Single:15
Double:7
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:266.338
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:3.29
LogP (Chemaxon):3.0

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Descriptor Annotations

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