Chemical ID: 7105277

c1ccc(cc1)C(CNCc2ccccc2Cl)O
Chemical ID:
7105277
Name [?]:
2-[(2-chlorophenyl)methylamino]-1-phenyl-ethanol
SMILES [?]:
c1ccc(cc1)C(CNCc2ccccc2Cl)O
InChi [?]:
InChI=1/C15H16ClNO/c16-14-9-5-4-8-13(14)10-17-11-15(18)12-6-2-1-3-7-12/h1-9,15,17-18H,10-11H2
InChi Info:
AuxInfo=1/0/N:1,2,6,13,14,3,5,12,15,10,8,4,11,16,7,17,9,18/E:(2,3)(6,7)/rA:18cCCCCCCCCNCCCCCCCClO/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;s9;s10;s11;d12;s13;d14;d11s15;s16;s7;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H16ClNO
All Atoms:34
Heavy Atoms:18
Chiral Atoms:1
ZAP Information [?]
Total:8.68764
Area:462.909
Solvation:-2.88508
Coulombic:-28.8672
Bond Count [?]
All:19
Single:13
Double:6
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:261.746
H-Bond Donors:2
H-Bond Acceptors:2
XLogP:3.26
LogP (Chemaxon):3.49

Name Annotations

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Descriptor Annotations

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