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Chemical ID: 6526541
Chemical ID:
6526541
Name [?]:
N-(2-hydroxyethyl)-N-methyl-benzamide
SMILES [?]:
CN(CCO)C(=O)c1ccccc1
InChi [?]:
InChI=1/C10H13NO2/c1-11(7-8-12)10(13)9-5-3-2-4-6-9/h2-6,12H,7-8H2,1H3
InChi Info:
AuxInfo=1/0/N:1,11,10,12,9,13,3,4,8,6,2,5,7/E:(3,4)(5,6)/rA:13nCNCCOCOCCCCCC/rB:s1;s2;s3;s4;s2;d6;s6;s8;d9;s10;d11;d8s12;/rC:;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C10H13NO2 |
All Atoms: | 13 |
Heavy Atoms: | 13 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 5.12421 |
Area: | 345.424 |
Solvation: | -3.51138 |
Coulombic: | -33.8023 |
Bond Count [?]
All: | 13 |
Single: | 9 |
Double: | 4 |
Rotors: | 4 |
Chiral: | 0 |
Rigid Segments: | 4 |
Chemical Properties
Molecular Weight: | 179.216 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 3 |
XLogP: | 0.86 |
LogP (Chemaxon): | 0.75 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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