Chemical ID: 4968025

c1ccc(cc1)CC(=O)N(CCO)CCO
Chemical ID:
4968025
Name [?]:
N,N-bis(2-hydroxyethyl)-2-phenyl-acetamide
SMILES [?]:
c1ccc(cc1)CC(=O)N(CCO)CCO
InChi [?]:
InChI=1/C12H17NO3/c14-8-6-13(7-9-15)12(16)10-11-4-2-1-3-5-11/h1-5,14-15H,6-10H2
InChi Info:
AuxInfo=1/0/N:1,2,6,3,5,11,14,12,15,7,4,8,10,13,16,9/E:(2,3)(4,5)(6,7)(8,9)(14,15)/rA:16nCCCCCCCCONCCOCCO/rB:s1;d2;s3;d4;d1s5;s4;s7;d8;s8;s10;s11;s12;s10;s14;s15;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H17NO3
All Atoms:16
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:5.75049
Area:414.77
Solvation:-4.61875
Coulombic:-49.1341
Bond Count [?]
All:16
Single:12
Double:4
Rotors:7
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:223.268
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:-0.04
LogP (Chemaxon):0.42

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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