Chemical ID: 7101516

CCOCCCNCc1cccnc1
Chemical ID:
7101516
Name [?]:
3-ethoxy-N-(3-pyridylmethyl)propan-1-amine
SMILES [?]:
CCOCCCNCc1cccnc1
InChi [?]:
InChI=1/C11H18N2O/c1-2-14-8-4-7-13-10-11-5-3-6-12-9-11/h3,5-6,9,13H,2,4,7-8,10H2,1H3
InChi Info:
AuxInfo=1/0/N:1,2,11,5,10,12,6,4,14,8,9,13,7,3/rA:14nCCOCCCNCCCCCNC/rB:s1;s2;s3;s4;s5;s6;s7;s8;s9;d10;s11;d12;d9s13;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H18N2O
All Atoms:32
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:7.02653
Area:415.441
Solvation:-3.3595
Coulombic:-21.0055
Bond Count [?]
All:14
Single:11
Double:3
Rotors:7
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:194.273
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:0.87
LogP (Chemaxon):0.49

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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