Chemical ID: 4712165

Cc1c(cnc(n1)N2CCCC2)C(=O)N3CCCC3
Chemical ID:
4712165
Name [?]:
(4-methyl-2-pyrrolidin-1-yl-pyrimidin-5-yl)-pyrrolidin-1-yl-methanone
SMILES [?]:
Cc1c(cnc(n1)N2CCCC2)C(=O)N3CCCC3
InChi [?]:
InChI=1/C14H20N4O/c1-11-12(13(19)17-6-2-3-7-17)10-15-14(16-11)18-8-4-5-9-18/h10H,2-9H2,1H3
InChi Info:
AuxInfo=1/0/N:1,17,18,10,11,16,19,9,12,4,2,3,13,6,5,7,15,8,14/E:(2,3)(4,5)(6,7)(8,9)/rA:19nCCCCNCNNCCCCCONCCCC/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;s9;s10;s8s11;s3;d13;s13;s15;s16;s17;s15s18;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H20N4O
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:8.59991
Area:443.389
Solvation:-2.48481
Coulombic:-34.3049
Bond Count [?]
All:21
Single:17
Double:4
Rotors:3
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:260.335
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:1.54
LogP (Chemaxon):0.82

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Descriptor Annotations

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