Chemical ID: 7089087

CC1CCC(N1c2ccccc2)C
Chemical ID:
7089087
Name [?]:
2,5-dimethyl-1-phenyl-pyrrolidine
SMILES [?]:
CC1CCC(N1c2ccccc2)C
InChi [?]:
InChI=1/C12H17N/c1-10-8-9-11(2)13(10)12-6-4-3-5-7-12/h3-7,10-11H,8-9H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,13,10,9,11,8,12,3,4,2,5,7,6/E:(1,2)(4,5)(6,7)(8,9)(10,11)/rA:13cCCCCCNCCCCCCC/rB:s1;s2;s3;s4;s2s5;s6;s7;d8;s9;d10;d7s11;s5;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H17N
All Atoms:30
Heavy Atoms:13
Chiral Atoms:2
ZAP Information [?]
Total:7.41213
Area:337.117
Solvation:-1.01581
Coulombic:-8.00268
Bond Count [?]
All:14
Single:11
Double:3
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:175.27
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:3.66
LogP (Chemaxon):3.46

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Descriptor Annotations

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