Chemical ID: 6355658

CC1CCN(CC1)C(=O)CCl
Chemical ID:
6355658
Name [?]:
2-chloro-1-(4-methyl-1-piperidyl)-ethanone
SMILES [?]:
CC1CCN(CC1)C(=O)CCl
InChi [?]:
InChI=1/C8H14ClNO/c1-7-2-4-10(5-3-7)8(11)6-9/h7H,2-6H2,1H3
InChi Info:
AuxInfo=1/0/N:1,3,7,4,6,10,2,8,11,5,9/E:(2,3)(4,5)/rA:11nCCCCNCCCOCCl/rB:s1;s2;s3;s4;s5;s2s6;s5;d8;s8;s10;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C8H14ClNO
All Atoms:11
Heavy Atoms:11
Chiral Atoms:0
ZAP Information [?]
Total:6.30643
Area:336.639
Solvation:-2.10955
Coulombic:-16.0027
Bond Count [?]
All:11
Single:10
Double:1
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:175.656
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:1.46
LogP (Chemaxon):1.1

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Experimental Annotations

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Descriptor Annotations

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