Chemical ID: 4966000

CCN1CCCc2c1cccc2
Chemical ID:
4966000
Name [?]:
1-ethyl-3,4-dihydro-2H-quinoline
SMILES [?]:
CCN1CCCc2c1cccc2
InChi [?]:
InChI=1/C11H15N/c1-2-12-9-5-7-10-6-3-4-8-11(10)12/h3-4,6,8H,2,5,7,9H2,1H3
InChi Info:
AuxInfo=1/0/N:1,2,11,10,5,12,6,9,4,7,8,3/rA:12cCCNCCCCCCCCC/rB:s1;s2;s3;s4;s5;s6;s3s7;d8;s9;d10;d7s11;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H15N
All Atoms:12
Heavy Atoms:12
Chiral Atoms:1
ZAP Information [?]
Total:6.79564
Area:319.615
Solvation:-1.19474
Coulombic:-7.51817
Bond Count [?]
All:13
Single:10
Double:3
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:161.244
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:2.86
LogP (Chemaxon):3.03

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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