Chemical ID: 6431862

CC(C)(C)C(=O)NC(c1ccc(cc1)Cl)NC(=O)C(C)(C)C
Chemical ID:
6431862
Name [?]:
N-[(4-chlorophenyl)-(2,2-dimethylpropanoylamino)methyl]-2,2-dimethyl-propanamide
SMILES [?]:
CC(C)(C)C(=O)NC(c1ccc(cc1)Cl)NC(=O)C(C)(C)C
InChi [?]:
InChI=1/C17H25ClN2O2/c1-16(2,3)14(21)19-13(20-15(22)17(4,5)6)11-7-9-12(18)10-8-11/h7-10,13H,1-6H3,(H,19,21)(H,20,22)
InChi Info:
AuxInfo=1/1/N:1,3,4,20,21,22,10,14,11,13,9,12,8,5,17,2,19,15,7,16,6,18/E:(1,2,3,4,5,6)(7,8)(9,10)(14,15)(16,17)(19,20)(21,22)/gE:(1,2)/rA:22nCCCCCONCCCCCCCClNCOCCCC/rB:s1;s2;s2;s2;d5;s5;s7;s8;s9;d10;s11;d12;d9s13;s12;s8;s16;d17;s17;s19;s19;s19;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H25ClN2O2
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:10.2826
Area:536.64
Solvation:-3.13336
Coulombic:-43.6421
Bond Count [?]
All:22
Single:17
Double:5
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:324.845
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:3.28
LogP (Chemaxon):4.59

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