Chemical ID: 4122347

CC(COC)NCc1ccccc1F
Chemical ID:
4122347
Name [?]:
N-[(2-fluorophenyl)methyl]-1-methoxy-propan-2-amine
SMILES [?]:
CC(COC)NCc1ccccc1F
InChi [?]:
InChI=1/C11H16FNO/c1-9(8-14-2)13-7-10-5-3-4-6-11(10)12/h3-6,9,13H,7-8H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,5,10,11,9,12,7,3,2,8,13,14,6,4/rA:14cCCCOCNCCCCCCCF/rB:s1;s2;s3;s4;s2;s6;s7;s8;d9;s10;d11;d8s12;s13;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H16FNO
All Atoms:14
Heavy Atoms:14
Chiral Atoms:1
ZAP Information [?]
Total:6.00634
Area:384.232
Solvation:-3.59945
Coulombic:-21.2637
Bond Count [?]
All:14
Single:11
Double:3
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:197.249
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:1.97
LogP (Chemaxon):1.96

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Descriptor Annotations

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