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Chemical ID: 7685036
Chemical ID:
7685036
Name [?]:
None
SMILES [?]:
CCCC(=O)NCCc1c[nH]c2c1cc(cc2)C
InChi [?]:
InChI=1/C15H20N2O/c1-3-4-15(18)16-8-7-12-10-17-14-6-5-11(2)9-13(12)14/h5-6,9-10,17H,3-4,7-8H2,1-2H3,(H,16,18)
InChi Info:
AuxInfo=1/1/N:1,18,2,3,16,17,8,7,14,10,15,9,13,12,4,6,11,5/rA:18nCCCCONCCCCNCCCCCCC/rB:s1;s2;s3;d4;s4;s6;s7;s8;d9;s10;s11;s9s12;d13;s14;d15;d12s16;s15;/rC:;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C15H20N2O |
All Atoms: | 38 |
Heavy Atoms: | 18 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 9.37178 |
Area: | 468.564 |
Solvation: | -2.34232 |
Coulombic: | -31.9056 |
Bond Count [?]
All: | 19 |
Single: | 14 |
Double: | 5 |
Rotors: | 6 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 2.91 |
LogP (Chemaxon): | None |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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