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Chemical ID: 5520053

Chemical ID:

5520053

Name [?]:

N-(4-methoxyphenyl)-2-(methyl-(p-tolylmethyl)amino)-acetamide

SMILES [?]:

Cc1ccc(cc1)CN(C)CC(=O)Nc2ccc(cc2)OC

InChi [?]:

InChI=1/C18H22N2O2/c1-14-4-6-15(7-5-14)12-20(2)13-18(21)19-16-8-10-17(22-3)11-9-16/h4-11H,12-13H2,1-3H3,(H,19,21)

InChi Info:

AuxInfo=1/1/N:1,10,22,3,7,4,6,16,20,17,19,8,11,2,5,15,18,12,14,9,13,21/E:(4,5)(6,7)(8,9)(10,11)/rA:22cCCCCCCCCNCCCONCCCCCCOC/rB:s1;s2;d3;s4;d5;d2s6;s5;s8;s9;s9;s11;d12;s12;s14;s15;d16;s17;d18;d15s19;s18;s21;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₁₈H₂₂N₂O₂
All Atoms:	22
Heavy Atoms:	22
Chiral Atoms:	1

ZAP Information [?]

Total:	8.69944
Area:	524.232
Solvation:	-4.40635
Coulombic:	-33.2151

Bond Count [?]

All:	23
Single:	16
Double:	7
Rotors:	7
Chiral:	0
Rigid Segments:	5

Chemical Properties

Molecular Weight:	298.38
H-Bond Donors:	1
H-Bond Acceptors:	4
XLogP:	2.86
LogP (Chemaxon):	3.23

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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Chemical Mix	Source	External ID	Descriptor	Value