Chemical ID: 4874069

c1ccc(cc1)C2CC(=O)NC2
Chemical ID:
4874069
Name [?]:
4-phenylpyrrolidin-2-one
SMILES [?]:
c1ccc(cc1)C2CC(=O)NC2
InChi [?]:
InChI=1/C10H11NO/c12-10-6-9(7-11-10)8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,11,12)
InChi Info:
AuxInfo=1/1/N:1,2,6,3,5,8,12,4,7,9,11,10/E:(2,3)(4,5)/rA:12cCCCCCCCCCONC/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;d9;s9;s7s11;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H11NO
All Atoms:12
Heavy Atoms:12
Chiral Atoms:1
ZAP Information [?]
Total:6.21964
Area:325.327
Solvation:-1.91354
Coulombic:-21.503
Bond Count [?]
All:13
Single:9
Double:4
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:161.2
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:1.07
LogP (Chemaxon):0.98

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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