Chemical ID: 7100139

Cc1ccc(c(c1)C2CCCN2)C
Chemical ID:
7100139
Name [?]:
2-(2,5-dimethylphenyl)pyrrolidine
SMILES [?]:
Cc1ccc(c(c1)C2CCCN2)C
InChi [?]:
InChI=1/C12H17N/c1-9-5-6-10(2)11(8-9)12-4-3-7-13-12/h5-6,8,12-13H,3-4,7H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,13,10,9,3,4,11,7,2,5,6,8,12/rA:13cCCCCCCCCCCCNC/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;s9;s10;s8s11;s5;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H17N
All Atoms:30
Heavy Atoms:13
Chiral Atoms:1
ZAP Information [?]
Total:7.76601
Area:347.214
Solvation:-0.914328
Coulombic:-10.2168
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:3.02
LogP (Chemaxon):2.9

Name Annotations

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Descriptor Annotations

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