Chemical ID: 4759905

CC(C)(C)OC(=O)NC(Cc1ccccc1)C(=O)NC
Chemical ID:
4759905
Name [?]:
tert-butyl [1-(methylcarbamoyl)-2-phenyl-ethyl]aminoformate
SMILES [?]:
CC(C)(C)OC(=O)NC(Cc1ccccc1)C(=O)NC
InChi [?]:
InChI=1/C15H22N2O3/c1-15(2,3)20-14(19)17-12(13(18)16-4)10-11-8-6-5-7-9-11/h5-9,12H,10H2,1-4H3,(H,16,18)(H,17,19)
InChi Info:
AuxInfo=1/1/N:1,3,4,20,14,13,15,12,16,10,11,9,17,6,2,19,8,18,7,5/E:(1,2,3)(6,7)(8,9)/rA:20cCCCCOCONCCCCCCCCCONC/rB:s1;s2;s2;s2;s5;d6;s6;s8;s9;s10;s11;d12;s13;d14;d11s15;s9;d17;s17;s19;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H22N2O3
All Atoms:20
Heavy Atoms:20
Chiral Atoms:1
ZAP Information [?]
Total:9.29681
Area:491.856
Solvation:-2.9996
Coulombic:-55.7629
Bond Count [?]
All:20
Single:15
Double:5
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:278.347
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:2.32
LogP (Chemaxon):1.82

Name Annotations

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Descriptor Annotations

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