Chemical ID: 6524947

CCOC(=O)C1CCCN(C1)C(=O)Nc2ccccc2
Chemical ID:
6524947
Name [?]:
ethyl 1-(phenylcarbamoyl)piperidine-3-carboxylate
SMILES [?]:
CCOC(=O)C1CCCN(C1)C(=O)Nc2ccccc2
InChi [?]:
InChI=1/C15H20N2O3/c1-2-20-14(18)12-7-6-10-17(11-12)15(19)16-13-8-4-3-5-9-13/h3-5,8-9,12H,2,6-7,10-11H2,1H3,(H,16,19)
InChi Info:
AuxInfo=1/1/N:1,2,18,17,19,8,7,16,20,9,11,6,15,4,12,14,10,5,13,3/E:(4,5)(8,9)/rA:20cCCOCOCCCCNCCONCCCCCC/rB:s1;s2;s3;d4;s4;s6;s7;s8;s9;s6s10;s10;d12;s12;s14;s15;d16;s17;d18;d15s19;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H20N2O3
All Atoms:20
Heavy Atoms:20
Chiral Atoms:1
ZAP Information [?]
Total:9.39956
Area:484.856
Solvation:-2.72183
Coulombic:-49.0771
Bond Count [?]
All:21
Single:16
Double:5
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:276.331
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:1.72
LogP (Chemaxon):2.16

Name Annotations

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Descriptor Annotations

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