Chemical ID: 4017237

CCOC(=O)C1CCN(CC1)C(=O)Nc2ccccc2OC
Chemical ID:
4017237
Name [?]:
ethyl 1-[(2-methoxyphenyl)carbamoyl]piperidine-4-carboxylate
SMILES [?]:
CCOC(=O)C1CCN(CC1)C(=O)Nc2ccccc2OC
InChi [?]:
InChI=1/C16H22N2O4/c1-3-22-15(19)12-8-10-18(11-9-12)16(20)17-13-6-4-5-7-14(13)21-2/h4-7,12H,3,8-11H2,1-2H3,(H,17,20)
InChi Info:
AuxInfo=1/1/N:1,22,2,17,18,16,19,7,11,8,10,6,15,20,4,12,14,9,5,13,21,3/E:(8,9)(10,11)/rA:22nCCOCOCCCNCCCONCCCCCCOC/rB:s1;s2;s3;d4;s4;s6;s7;s8;s9;s6s10;s9;d12;s12;s14;s15;d16;s17;d18;d15s19;s20;s21;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H22N2O4
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:9.24264
Area:519.535
Solvation:-3.74575
Coulombic:-56.3136
Bond Count [?]
All:23
Single:18
Double:5
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:306.357
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:1.63
LogP (Chemaxon):1.77

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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