Chemical ID: 6665806

Cc1ccc(c(c1)NC(=O)N(C)C)C
Chemical ID:
6665806
Name [?]:
3-(2,5-dimethylphenyl)-1,1-dimethyl-urea
SMILES [?]:
Cc1ccc(c(c1)NC(=O)N(C)C)C
InChi [?]:
InChI=1/C11H16N2O/c1-8-5-6-9(2)10(7-8)12-11(14)13(3)4/h5-7H,1-4H3,(H,12,14)
InChi Info:
AuxInfo=1/1/N:1,14,12,13,3,4,7,2,5,6,9,8,11,10/E:(3,4)/rA:14nCCCCCCCNCONCCC/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;d9;s9;s11;s11;s5;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H16N2O
All Atoms:14
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:7.63478
Area:372.519
Solvation:-1.67821
Coulombic:-30.5005
Bond Count [?]
All:14
Single:10
Double:4
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:192.258
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:1.72
LogP (Chemaxon):1.88

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Descriptor Annotations

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