Chemical ID: 4732167

CCN(CC)c1ccc(cn1)C(=O)OC
Chemical ID:
4732167
Name [?]:
methyl 6-diethylaminopyridine-3-carboxylate
SMILES [?]:
CCN(CC)c1ccc(cn1)C(=O)OC
InChi [?]:
InChI=1/C11H16N2O2/c1-4-13(5-2)10-7-6-9(8-12-10)11(14)15-3/h6-8H,4-5H2,1-3H3
InChi Info:
AuxInfo=1/0/N:1,5,15,2,4,8,7,10,9,6,12,11,3,13,14/E:(1,2)(4,5)/rA:15nCCNCCCCCCCNCOOC/rB:s1;s2;s3;s4;s3;s6;d7;s8;d9;d6s10;s9;d12;s12;s14;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H16N2O2
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:7.93668
Area:402.457
Solvation:-2.12475
Coulombic:-31.1018
Bond Count [?]
All:15
Single:11
Double:4
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:208.257
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:2.49
LogP (Chemaxon):1.93

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Descriptor Annotations

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