ChemDB: Chemical Search
Download
Chemical ID: 6356918
Chemical ID:
6356918
Name [?]:
N-(1H-tetrazol-5-yl)cyclopentanecarboxamide
SMILES [?]:
C1CCC(C1)C(=O)Nc2[nH]nnn2
InChi [?]:
InChI=1/C7H11N5O/c13-6(5-3-1-2-4-5)8-7-9-11-12-10-7/h5H,1-4H2,(H2,8,9,10,11,12,13)
InChi Info:
AuxInfo=1/1/N:1,2,5,3,4,6,9,8,10,13,11,12,7/E:(1,2)(3,4)(9,10)(11,12)/rA:13nCCCCCCONCNNNN/rB:s1;s2;s3;s1s4;s4;d6;s6;s8;s9;s10;d11;d9s12;/rC:;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C7H11N5O |
All Atoms: | 13 |
Heavy Atoms: | 13 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 7.06322 |
Area: | 341.95 |
Solvation: | -1.48554 |
Coulombic: | -30.6982 |
Bond Count [?]
All: | 14 |
Single: | 11 |
Double: | 3 |
Rotors: | 3 |
Chiral: | 0 |
Rigid Segments: | 3 |
Chemical Properties
Molecular Weight: | 181.195 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 2 |
XLogP: | 0.3 |
LogP (Chemaxon): | 1.01 |
Name Annotations
Note: All annotations are abbreviated. For more detailed information please download chemical.
Chemical | Mix Source | External ID | Descriptor | Value |
---|
Experimental Annotations
Note: All annotations are abbreviated. For more detailed information please download chemical.
Chemical Mix | Source | External ID | Descriptor | Value |
---|
Descriptor Annotations
Note: All annotations are abbreviated. For more detailed information please download chemical.
Chemical Mix | Source | External ID | Descriptor | Value |
---|