Chemical ID: 5832155

CCN(Cc1ccncc1)Cc2ccccc2F
Chemical ID:
5832155
Name [?]:
N-[(2-fluorophenyl)methyl]-N-(4-pyridylmethyl)ethanamine
SMILES [?]:
CCN(Cc1ccncc1)Cc2ccccc2F
InChi [?]:
InChI=1/C15H17FN2/c1-2-18(11-13-7-9-17-10-8-13)12-14-5-3-4-6-15(14)16/h3-10H,2,11-12H2,1H3
InChi Info:
AuxInfo=1/0/N:1,2,14,15,13,16,6,10,7,9,4,11,5,12,17,18,8,3/E:(7,8)(9,10)/rA:18cCCNCCCCNCCCCCCCCCF/rB:s1;s2;s3;s4;s5;d6;s7;d8;d5s9;s3;s11;s12;d13;s14;d15;d12s16;s17;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H17FN2
All Atoms:18
Heavy Atoms:18
Chiral Atoms:1
ZAP Information [?]
Total:7.54853
Area:429.618
Solvation:-3.19193
Coulombic:-14.4774
Bond Count [?]
All:19
Single:13
Double:6
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:244.307
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:2.81
LogP (Chemaxon):2.88

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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