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Chemical ID: 4685964
Chemical ID:
4685964
Name [?]:
1-(1H-tetrazol-5-yl)piperidine
SMILES [?]:
C1CCN(CC1)c2[nH]nnn2
InChi [?]:
InChI=1/C6H11N5/c1-2-4-11(5-3-1)6-7-9-10-8-6/h1-5H2,(H,7,8,9,10)
InChi Info:
AuxInfo=1/1/N:1,2,6,3,5,7,8,11,9,10,4/E:(2,3)(4,5)(7,8)(9,10)/rA:11nCCCNCCCNNNN/rB:s1;s2;s3;s4;s1s5;s4;s7;s8;d9;d7s10;/rC:;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C6H11N5 |
All Atoms: | 11 |
Heavy Atoms: | 11 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 6.35896 |
Area: | 301.408 |
Solvation: | -1.17625 |
Coulombic: | -17.8011 |
Bond Count [?]
All: | 12 |
Single: | 10 |
Double: | 2 |
Rotors: | 1 |
Chiral: | 0 |
Rigid Segments: | 2 |
Chemical Properties
Molecular Weight: | 153.185 |
H-Bond Donors: | 0 |
H-Bond Acceptors: | 1 |
XLogP: | 0.78 |
LogP (Chemaxon): | 1.19 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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