Chemical ID: 7087192

c1ccc2c(c1)c(ccn2)C(CN)O
Chemical ID:
7087192
Name [?]:
2-amino-1-(4-quinolyl)ethanol
SMILES [?]:
c1ccc2c(c1)c(ccn2)C(CN)O
InChi [?]:
InChI=1/C11H12N2O/c12-7-11(14)9-5-6-13-10-4-2-1-3-8(9)10/h1-6,11,14H,7,12H2
InChi Info:
AuxInfo=1/0/N:1,2,6,3,8,9,12,5,7,4,11,13,10,14/rA:14cCCCCCCCCCNCCNO/rB:s1;d2;s3;s4;d1s5;d5;s7;d8;d4s9;s7;s11;s12;s11;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H12N2O
All Atoms:26
Heavy Atoms:14
Chiral Atoms:1
ZAP Information [?]
Total:6.13698
Area:354.146
Solvation:-2.71667
Coulombic:-34.8107
Bond Count [?]
All:15
Single:10
Double:5
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:188.226
H-Bond Donors:3
H-Bond Acceptors:2
XLogP:0.64
LogP (Chemaxon):0.88

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Descriptor Annotations

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