Chemical ID: 6911936

Cc1c[nH]c2c1C(=O)CCC2
Chemical ID:
6911936
Name [?]:
3-methyl-1,5,6,7-tetrahydroindol-4-one
SMILES [?]:
Cc1c[nH]c2c1C(=O)CCC2
InChi [?]:
InChI=1/C9H11NO/c1-6-5-10-7-3-2-4-8(11)9(6)7/h5,10H,2-4H2,1H3
InChi Info:
AuxInfo=1/0/N:1,10,11,9,3,2,5,7,6,4,8/rA:11nCCCNCCCOCCC/rB:s1;d2;s3;s4;s2d5;s6;d7;s7;s9;s5s10;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C9H11NO
All Atoms:22
Heavy Atoms:11
Chiral Atoms:0
ZAP Information [?]
Total:5.68367
Area:296.933
Solvation:-1.73965
Coulombic:-17.8084
Bond Count [?]
All:12
Single:9
Double:3
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:149.19
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:0.77
LogP (Chemaxon):1.04

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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