Chemical ID: 6032257

CCCCN(CCC(=O)NCCCN1CCOCC1)C(=O)c2cc(oc2C)C
Chemical ID:
6032257
Name [?]:
N-butyl-2,5-dimethyl-N-[2-(3-morpholinopropylcarbamoyl)ethyl]furan-3-carboxamide
SMILES [?]:
CCCCN(CCC(=O)NCCCN1CCOCC1)C(=O)c2cc(oc2C)C
InChi [?]:
InChI=1/C21H35N3O4/c1-4-5-10-24(21(26)19-16-17(2)28-18(19)3)11-7-20(25)22-8-6-9-23-12-14-27-15-13-23/h16H,4-15H2,1-3H3,(H,22,25)
InChi Info:
AuxInfo=1/1/N:1,28,27,2,3,12,7,11,13,4,6,15,19,16,18,23,24,26,22,8,20,10,14,5,9,21,17,25/E:(12,13)(14,15)/rA:28nCCCCNCCCONCCCNCCOCCCOCCCOCCC/rB:s1;s2;s3;s4;s5;s6;s7;d8;s8;s10;s11;s12;s13;s14;s15;s16;s17;s14s18;s5;d20;s20;s22;d23;s24;d22s25;s26;s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C21H35N3O4
All Atoms:28
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:11.6709
Area:678.164
Solvation:-5.28318
Coulombic:-56.1125
Bond Count [?]
All:29
Single:25
Double:4
Rotors:13
Chiral:0
Rigid Segments:9
Chemical Properties
Molecular Weight:393.52
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:1.14
LogP (Chemaxon):0.4

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Descriptor Annotations

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