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Chemical ID: 7254644

Chemical ID:

7254644

Name [?]:

N-[4-(p-tolylmethylcarbamoylmethoxy)phenyl]acetamide

SMILES [?]:

Cc1ccc(cc1)CNC(=O)COc2ccc(cc2)NC(=O)C

InChi [?]:

InChI=1/C18H20N2O3/c1-13-3-5-15(6-4-13)11-19-18(22)12-23-17-9-7-16(8-10-17)20-14(2)21/h3-10H,11-12H2,1-2H3,(H,19,22)(H,20,21)

InChi Info:

AuxInfo=1/1/N:1,23,3,7,4,6,16,18,15,19,8,12,2,21,5,17,14,10,9,20,22,11,13/E:(3,4)(5,6)(7,8)(9,10)/rA:23nCCCCCCCCNCOCOCCCCCCNCOC/rB:s1;s2;d3;s4;d5;d2s6;s5;s8;s9;d10;s10;s12;s13;s14;d15;s16;d17;d14s18;s17;s20;d21;s21;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₁₈H₂₀N₂O₃
All Atoms:	43
Heavy Atoms:	23
Chiral Atoms:	0

ZAP Information [?]

Total:	8.81929
Area:	556.128
Solvation:	-5.08391
Coulombic:	-48.1416

Bond Count [?]

All:	24
Single:	16
Double:	8
Rotors:	8
Chiral:	0
Rigid Segments:	6

Chemical Properties

Molecular Weight:	312.363
H-Bond Donors:	2
H-Bond Acceptors:	5
XLogP:	2.51
LogP (Chemaxon):	2.29

Name Annotations

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Chemical	Mix Source	External ID	Descriptor	Value

Experimental Annotations

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Chemical Mix	Source	External ID	Descriptor	Value

Descriptor Annotations

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Chemical Mix	Source	External ID	Descriptor	Value