Chemical ID: 4177686

Cc1cccc(c1)CN2CCCC2CO
Chemical ID:
4177686
Name [?]:
[1-(m-tolylmethyl)pyrrolidin-2-yl]methanol
SMILES [?]:
Cc1cccc(c1)CN2CCCC2CO
InChi [?]:
InChI=1/C13H19NO/c1-11-4-2-5-12(8-11)9-14-7-3-6-13(14)10-15/h2,4-5,8,13,15H,3,6-7,9-10H2,1H3
InChi Info:
AuxInfo=1/0/N:1,4,11,3,5,12,10,7,8,14,2,6,13,9,15/rA:15cCCCCCCCCNCCCCCO/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;s9;s10;s11;s9s12;s13;s14;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H19NO
All Atoms:15
Heavy Atoms:15
Chiral Atoms:2
ZAP Information [?]
Total:7.40692
Area:389.082
Solvation:-2.32013
Coulombic:-23.164
Bond Count [?]
All:16
Single:13
Double:3
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:205.296
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:2.04
LogP (Chemaxon):2.35

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