Chemical ID: 5069411

Cc1cccc(c1)C2CC(CN2)C
Chemical ID:
5069411
Name [?]:
4-methyl-2-(m-tolyl)pyrrolidine
SMILES [?]:
Cc1cccc(c1)C2CC(CN2)C
InChi [?]:
InChI=1/C12H17N/c1-9-4-3-5-11(6-9)12-7-10(2)8-13-12/h3-6,10,12-13H,7-8H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,13,4,3,5,7,9,11,2,10,6,8,12/rA:13cCCCCCCCCCCCNC/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;s9;s10;s8s11;s10;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H17N
All Atoms:13
Heavy Atoms:13
Chiral Atoms:2
ZAP Information [?]
Total:7.98649
Area:355.612
Solvation:-0.903802
Coulombic:-10.7381
Bond Count [?]
All:14
Single:11
Double:3
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:175.27
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:2.88
LogP (Chemaxon):2.84

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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