Chemical ID: 5865219

CCC(C)NCCNC(=O)c1ccc(c(c1)OC)OC
Chemical ID:
5865219
Name [?]:
3,4-dimethoxy-N-(2-sec-butylaminoethyl)benzamide
SMILES [?]:
CCC(C)NCCNC(=O)c1ccc(c(c1)OC)OC
InChi [?]:
InChI=1/C15H24N2O3/c1-5-11(2)16-8-9-17-15(18)12-6-7-13(19-3)14(10-12)20-4/h6-7,10-11,16H,5,8-9H2,1-4H3,(H,17,18)
InChi Info:
AuxInfo=1/1/N:1,4,20,18,2,12,13,6,7,16,3,11,14,15,9,5,8,10,19,17/rA:20cCCCCNCCNCOCCCCCCOCOC/rB:s1;s2;s3;s3;s5;s6;s7;s8;d9;s9;s11;d12;s13;d14;d11s15;s15;s17;s14;s19;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H24N2O3
All Atoms:20
Heavy Atoms:20
Chiral Atoms:1
ZAP Information [?]
Total:7.57293
Area:516.846
Solvation:-5.34822
Coulombic:-44.5257
Bond Count [?]
All:20
Single:16
Double:4
Rotors:9
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:280.363
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:1.84
LogP (Chemaxon):1.28

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