Chemical ID: 7592672

CCCN1CCOC2C1CCc3c2cc(cc3)O
Chemical ID:
7592672
Name [?]:
None
SMILES [?]:
CCCN1CCOC2C1CCc3c2cc(cc3)O
InChi [?]:
InChI=1/C15H21NO2/c1-2-7-16-8-9-18-15-13-10-12(17)5-3-11(13)4-6-14(15)16/h3,5,10,14-15,17H,2,4,6-9H2,1H3
InChi Info:
AuxInfo=1/0/N:1,2,17,11,16,10,3,5,6,14,12,15,13,9,8,4,18,7/rA:18cCCCNCCOCCCCCCCCCCO/rB:s1;s2;s3;s4;s5;s6;s7;s4s8;s9;s10;s11;s8s12;d13;s14;d15;d12s16;s15;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H21NO2
All Atoms:39
Heavy Atoms:18
Chiral Atoms:None
ZAP Information [?]
Total:7.50471
Area:427.427
Solvation:-3.18096
Coulombic:-30.4418
Bond Count [?]
All:20
Single:17
Double:3
Rotors:2
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:2.09
LogP (Chemaxon):None

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue