Chemical ID: 6393413

c1ccc(cc1)CC(=O)N2CCCC2
Chemical ID:
6393413
Name [?]:
2-phenyl-1-pyrrolidin-1-yl-ethanone
SMILES [?]:
c1ccc(cc1)CC(=O)N2CCCC2
InChi [?]:
InChI=1/C12H15NO/c14-12(13-8-4-5-9-13)10-11-6-2-1-3-7-11/h1-3,6-7H,4-5,8-10H2
InChi Info:
AuxInfo=1/0/N:1,2,6,12,13,3,5,11,14,7,4,8,10,9/E:(2,3)(4,5)(6,7)(8,9)/rA:14nCCCCCCCCONCCCC/rB:s1;d2;s3;d4;d1s5;s4;s7;d8;s8;s10;s11;s12;s10s13;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H15NO
All Atoms:14
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:7.02297
Area:370.861
Solvation:-2.24855
Coulombic:-16.7048
Bond Count [?]
All:15
Single:11
Double:4
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:189.254
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:1.89
LogP (Chemaxon):1.63

Name Annotations

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Descriptor Annotations

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