Chemical ID: 7257031

CC(C)c1cccc(c1NC(=O)CNCCO)C(C)C
Chemical ID:
7257031
Name [?]:
N-(2,6-diisopropylphenyl)-2-(2-hydroxyethylamino)acetamide
SMILES [?]:
CC(C)c1cccc(c1NC(=O)CNCCO)C(C)C
InChi [?]:
InChI=1/C16H26N2O2/c1-11(2)13-6-5-7-14(12(3)4)16(13)18-15(20)10-17-8-9-19/h5-7,11-12,17,19H,8-10H2,1-4H3,(H,18,20)
InChi Info:
AuxInfo=1/1/N:1,3,19,20,6,5,7,15,16,13,2,18,4,8,11,9,14,10,17,12/E:(1,2,3,4)(6,7)(11,12)(13,14)/rA:20nCCCCCCCCCNCOCNCCOCCC/rB:s1;s2;s2;s4;d5;s6;d7;d4s8;s9;s10;d11;s11;s13;s14;s15;s16;s8;s18;s18;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H26N2O2
All Atoms:46
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:8.05875
Area:501.422
Solvation:-4.4768
Coulombic:-45.7031
Bond Count [?]
All:20
Single:16
Double:4
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:278.39
H-Bond Donors:3
H-Bond Acceptors:4
XLogP:2.24
LogP (Chemaxon):1.52

Name Annotations

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Descriptor Annotations

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