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Chemical ID: 4955376

Chemical ID:

4955376

Name [?]:

N-[4-(2-diethylaminoethoxy)phenyl]acetamide

SMILES [?]:

CCN(CC)CCOc1ccc(cc1)NC(=O)C

InChi [?]:

InChI=1/C14H22N2O2/c1-4-16(5-2)10-11-18-14-8-6-13(7-9-14)15-12(3)17/h6-9H,4-5,10-11H2,1-3H3,(H,15,17)

InChi Info:

AuxInfo=1/1/N:1,5,18,2,4,11,13,10,14,6,7,16,12,9,15,3,17,8/E:(1,2)(4,5)(6,7)(8,9)/rA:18nCCNCCCCOCCCCCCNCOC/rB:s1;s2;s3;s4;s3;s6;s7;s8;s9;d10;s11;d12;d9s13;s12;s15;d16;s16;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₁₄H₂₂N₂O₂
All Atoms:	18
Heavy Atoms:	18
Chiral Atoms:	0

ZAP Information [?]

Total:	8.26839
Area:	467.197
Solvation:	-3.41154
Coulombic:	-31.522

Bond Count [?]

All:	18
Single:	14
Double:	4
Rotors:	8
Chiral:	0
Rigid Segments:	6

Chemical Properties

Molecular Weight:	250.337
H-Bond Donors:	1
H-Bond Acceptors:	4
XLogP:	1.89
LogP (Chemaxon):	1.78

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