Chemical ID: 6581863

CCOC(=O)C1CCN(CC1)CC(=O)Nc2ccc(cc2)C(=O)OC
Chemical ID:
6581863
Name [?]:
ethyl 1-[(4-methoxycarbonylphenyl)carbamoylmethyl]piperidine-4-carboxylate
SMILES [?]:
CCOC(=O)C1CCN(CC1)CC(=O)Nc2ccc(cc2)C(=O)OC
InChi [?]:
InChI=1/C18H24N2O5/c1-3-25-18(23)14-8-10-20(11-9-14)12-16(21)19-15-6-4-13(5-7-15)17(22)24-2/h4-7,14H,3,8-12H2,1-2H3,(H,19,21)
InChi Info:
AuxInfo=1/1/N:1,25,2,18,20,17,21,7,11,8,10,12,19,6,16,13,22,4,15,9,14,23,5,24,3/E:(4,5)(6,7)(8,9)(10,11)/rA:25nCCOCOCCCNCCCCONCCCCCCCOOC/rB:s1;s2;s3;d4;s4;s6;s7;s8;s9;s6s10;s9;s12;d13;s13;s15;s16;d17;s18;d19;d16s20;s19;d22;s22;s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H24N2O5
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:9.81058
Area:587.729
Solvation:-4.88264
Coulombic:-62.3315
Bond Count [?]
All:26
Single:20
Double:6
Rotors:9
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:348.394
H-Bond Donors:1
H-Bond Acceptors:7
XLogP:1.4
LogP (Chemaxon):1.21

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Descriptor Annotations

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