Chemical ID: 5894293

CCCCNC(=O)Nc1ccc(c(c1)C(=O)NC2CC2)N3CCCC3
Chemical ID:
5894293
Name [?]:
5-(butylcarbamoylamino)-N-cyclopropyl-2-pyrrolidin-1-yl-benzamide
SMILES [?]:
CCCCNC(=O)Nc1ccc(c(c1)C(=O)NC2CC2)N3CCCC3
InChi [?]:
InChI=1/C19H28N4O2/c1-2-3-10-20-19(25)22-15-8-9-17(23-11-4-5-12-23)16(13-15)18(24)21-14-6-7-14/h8-9,13-14H,2-7,10-12H2,1H3,(H,21,24)(H2,20,22,25)
InChi Info:
AuxInfo=1/1/N:1,2,3,23,24,19,20,10,11,4,22,25,14,18,9,13,12,15,6,5,17,8,21,16,7/E:(4,5)(6,7)(11,12)/rA:25nCCCCNCONCCCCCCCONCCCNCCCC/rB:s1;s2;s3;s4;s5;d6;s6;s8;s9;d10;s11;d12;d9s13;s13;d15;s15;s17;s18;s18s19;s12;s21;s22;s23;s21s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H28N4O2
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:11.2667
Area:595.684
Solvation:-3.62536
Coulombic:-61.3711
Bond Count [?]
All:27
Single:22
Double:5
Rotors:10
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:344.451
H-Bond Donors:3
H-Bond Acceptors:6
XLogP:2.93
LogP (Chemaxon):2.44

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Descriptor Annotations

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