Chemical ID: 4558006

CC(C(c1ccccc1)O)N(C)CCO
Chemical ID:
4558006
Name [?]:
2-(2-hydroxyethyl-methyl-amino)-1-phenyl-propan-1-ol
SMILES [?]:
CC(C(c1ccccc1)O)N(C)CCO
InChi [?]:
InChI=1/C12H19NO2/c1-10(13(2)8-9-14)12(15)11-6-4-3-5-7-11/h3-7,10,12,14-15H,8-9H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,12,7,6,8,5,9,13,14,2,4,3,11,15,10/E:(4,5)(6,7)/rA:15cCCCCCCCCCONCCCO/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s3;s2;s11;s11;s13;s14;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H19NO2
All Atoms:15
Heavy Atoms:15
Chiral Atoms:3
ZAP Information [?]
Total:5.23614
Area:392.662
Solvation:-4.58042
Coulombic:-38.6897
Bond Count [?]
All:15
Single:12
Double:3
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:209.285
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:0.92
LogP (Chemaxon):1.53

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Descriptor Annotations

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