Chemical ID: 7300169

CC(=O)Nc1ccc(cc1)C(=O)OCC(=O)NC2CC2
Chemical ID:
7300169
Name [?]:
cyclopropylcarbamoylmethyl 4-acetamidobenzoate
SMILES [?]:
CC(=O)Nc1ccc(cc1)C(=O)OCC(=O)NC2CC2
InChi [?]:
InChI=1/C14H16N2O4/c1-9(17)15-11-4-2-10(3-5-11)14(19)20-8-13(18)16-12-6-7-12/h2-5,12H,6-8H2,1H3,(H,15,17)(H,16,18)
InChi Info:
AuxInfo=1/1/N:1,7,9,6,10,19,20,14,2,8,5,18,15,11,4,17,3,16,12,13/E:(2,3)(4,5)(6,7)/rA:20nCCONCCCCCCCOOCCONCCC/rB:s1;d2;s2;s4;s5;d6;s7;d8;d5s9;s8;d11;s11;s13;s14;d15;s15;s17;s18;s18s19;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H16N2O4
All Atoms:36
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:8.29188
Area:500.541
Solvation:-4.22165
Coulombic:-59.2456
Bond Count [?]
All:21
Single:15
Double:6
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:276.288
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:0.93
LogP (Chemaxon):0.24

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