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Chemical ID: 4420866

Chemical ID:

4420866

Name [?]:

N'-cyclopropyl-N-(2-ethylhexyl)oxamide

SMILES [?]:

CCCCC(CC)CNC(=O)C(=O)NC1CC1

InChi [?]:

InChI=1/C13H24N2O2/c1-3-5-6-10(4-2)9-14-12(16)13(17)15-11-7-8-11/h10-11H,3-9H2,1-2H3,(H,14,16)(H,15,17)

InChi Info:

AuxInfo=1/1/N:1,7,2,6,3,4,16,17,8,5,15,10,12,9,14,11,13/E:(7,8)/rA:17cCCCCCCCCNCOCONCCC/rB:s1;s2;s3;s4;s5;s6;s5;s8;s9;d10;s10;d12;s12;s14;s15;s15s16;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₁₃H₂₄N₂O₂
All Atoms:	17
Heavy Atoms:	17
Chiral Atoms:	1

ZAP Information [?]

Total:	10.8379
Area:	489.042
Solvation:	-1.38814
Coulombic:	-48.627

Bond Count [?]

All:	17
Single:	15
Double:	2
Rotors:	10
Chiral:	0
Rigid Segments:	7

Chemical Properties

Molecular Weight:	240.342
H-Bond Donors:	2
H-Bond Acceptors:	4
XLogP:	2.79
LogP (Chemaxon):	1.72

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