Chemical ID: 7086694

c1cc(cc(c1)CN2CCCC2)CN
Chemical ID:
7086694
Name [?]:
[3-(pyrrolidin-1-ylmethyl)phenyl]methanamine
SMILES [?]:
c1cc(cc(c1)CN2CCCC2)CN
InChi [?]:
InChI=1/C12H18N2/c13-9-11-4-3-5-12(8-11)10-14-6-1-2-7-14/h3-5,8H,1-2,6-7,9-10,13H2
InChi Info:
AuxInfo=1/0/N:10,11,1,2,6,9,12,4,13,7,3,5,14,8/E:(1,2)(6,7)/rA:14nCCCCCCCNCCCCCN/rB:s1;d2;s3;d4;d1s5;s5;s7;s8;s9;s10;s8s11;s3;s13;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H18N2
All Atoms:32
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:7.7592
Area:373.36
Solvation:-1.57479
Coulombic:-18.3045
Bond Count [?]
All:15
Single:12
Double:3
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:190.285
H-Bond Donors:2
H-Bond Acceptors:2
XLogP:1.4
LogP (Chemaxon):1.38

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Descriptor Annotations

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