Chemical ID: 5758429

CC1CN(CCC1=O)C(C)(C)C
Chemical ID:
5758429
Name [?]:
3-methyl-1-tert-butyl-piperidin-4-one
SMILES [?]:
CC1CN(CCC1=O)C(C)(C)C
InChi [?]:
InChI=1/C10H19NO/c1-8-7-11(10(2,3)4)6-5-9(8)12/h8H,5-7H2,1-4H3
InChi Info:
AuxInfo=1/0/N:1,10,11,12,6,5,3,2,7,9,4,8/E:(2,3,4)/rA:12cCCCNCCCOCCCC/rB:s1;s2;s3;s4;s5;s2s6;d7;s4;s9;s9;s9;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H19NO
All Atoms:12
Heavy Atoms:12
Chiral Atoms:2
ZAP Information [?]
Total:6.23567
Area:334.152
Solvation:-2.11813
Coulombic:-11.6998
Bond Count [?]
All:12
Single:11
Double:1
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:169.264
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:1.08
LogP (Chemaxon):1.71

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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