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Chemical ID: 4584863
Chemical ID:
4584863
Name [?]:
2-amino-N-benzhydryl-acetamide
SMILES [?]:
c1ccc(cc1)C(c2ccccc2)NC(=O)CN
InChi [?]:
InChI=1/C15H16N2O/c16-11-14(18)17-15(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10,15H,11,16H2,(H,17,18)
InChi Info:
AuxInfo=1/1/N:1,11,2,6,10,12,3,5,9,13,17,4,8,15,7,18,14,16/E:(1,2)(3,4,5,6)(7,8,9,10)(12,13)/rA:18nCCCCCCCCCCCCCNCOCN/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;d9;s10;d11;d8s12;s7;s14;d15;s15;s17;/rC:;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C15H16N2O |
All Atoms: | 18 |
Heavy Atoms: | 18 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 8.02043 |
Area: | 439.92 |
Solvation: | -2.97757 |
Coulombic: | -35.6291 |
Bond Count [?]
All: | 19 |
Single: | 12 |
Double: | 7 |
Rotors: | 5 |
Chiral: | 0 |
Rigid Segments: | 5 |
Chemical Properties
Molecular Weight: | 240.3 |
H-Bond Donors: | 3 |
H-Bond Acceptors: | 3 |
XLogP: | 1.89 |
LogP (Chemaxon): | 1.93 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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