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Chemical ID: 6347709
Chemical ID:
6347709
Name [?]:
cyclopentyl-(3-methyl-1-piperidyl)-methanone
SMILES [?]:
CC1CCCN(C1)C(=O)C2CCCC2
InChi [?]:
InChI=1/C12H21NO/c1-10-5-4-8-13(9-10)12(14)11-6-2-3-7-11/h10-11H,2-9H2,1H3
InChi Info:
AuxInfo=1/0/N:1,12,13,4,3,11,14,5,7,2,10,8,6,9/E:(2,3)(6,7)/rA:14cCCCCCNCCOCCCCC/rB:s1;s2;s3;s4;s5;s2s6;s6;d8;s8;s10;s11;s12;s10s13;/rC:;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C12H21NO |
All Atoms: | 14 |
Heavy Atoms: | 14 |
Chiral Atoms: | 1 |
ZAP Information [?]
Total: | 7.87312 |
Area: | 373.406 |
Solvation: | -1.46204 |
Coulombic: | -17.0223 |
Bond Count [?]
All: | 15 |
Single: | 14 |
Double: | 1 |
Rotors: | 2 |
Chiral: | 0 |
Rigid Segments: | 3 |
Chemical Properties
Molecular Weight: | 195.301 |
H-Bond Donors: | 0 |
H-Bond Acceptors: | 2 |
XLogP: | 2.36 |
LogP (Chemaxon): | 2.06 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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