Chemical ID: 4672373

CCN1CCC(c2c1cccc2)N(C)CC
Chemical ID:
4672373
Name [?]:
N,1-diethyl-N-methyl-3,4-dihydro-2H-quinolin-4-amine
SMILES [?]:
CCN1CCC(c2c1cccc2)N(C)CC
InChi [?]:
InChI=1/C14H22N2/c1-4-15(3)13-10-11-16(5-2)14-9-7-6-8-12(13)14/h6-9,13H,4-5,10-11H2,1-3H3
InChi Info:
AuxInfo=1/0/N:16,1,14,15,2,11,10,12,9,5,4,7,6,8,13,3/rA:16cCCNCCCCCCCCCNCCC/rB:s1;s2;s3;s4;s5;s6;s3s7;d8;s9;d10;d7s11;s6;s13;s13;s15;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H22N2
All Atoms:16
Heavy Atoms:16
Chiral Atoms:3
ZAP Information [?]
Total:8.37053
Area:396.1
Solvation:-1.53198
Coulombic:-12.6749
Bond Count [?]
All:17
Single:14
Double:3
Rotors:3
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:218.338
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:3.08
LogP (Chemaxon):2.83

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Experimental Annotations

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Descriptor Annotations

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