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Chemical ID: 4246732
Chemical ID:
4246732
Name [?]:
N-[(2-methoxyphenyl)methyl]-6-methyl-pyridin-2-amine
SMILES [?]:
Cc1cccc(n1)NCc2ccccc2OC
InChi [?]:
InChI=1/C14H16N2O/c1-11-6-5-9-14(16-11)15-10-12-7-3-4-8-13(12)17-2/h3-9H,10H2,1-2H3,(H,15,16)
InChi Info:
AuxInfo=1/1/N:1,17,12,13,4,3,11,14,5,9,2,10,15,6,8,7,16/rA:17nCCCCCCNNCCCCCCCOC/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;s9;s10;d11;s12;d13;d10s14;s15;s16;/rC:;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C14H16N2O |
All Atoms: | 17 |
Heavy Atoms: | 17 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 7.36237 |
Area: | 425.778 |
Solvation: | -3.28208 |
Coulombic: | -24.7547 |
Bond Count [?]
All: | 18 |
Single: | 12 |
Double: | 6 |
Rotors: | 4 |
Chiral: | 0 |
Rigid Segments: | 4 |
Chemical Properties
Molecular Weight: | 228.29 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 2 |
XLogP: | 3.08 |
LogP (Chemaxon): | 2.7 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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