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Chemical ID: 6048698
Chemical ID:
6048698
Name [?]:
4-(2-pyridyl)aniline
SMILES [?]:
c1ccnc(c1)c2ccc(cc2)N
InChi [?]:
InChI=1/C11H10N2/c12-10-6-4-9(5-7-10)11-3-1-2-8-13-11/h1-8H,12H2
InChi Info:
AuxInfo=1/0/N:1,2,6,8,12,9,11,3,7,10,5,13,4/E:(4,5)(6,7)/rA:13nCCCNCCCCCCCCN/rB:s1;d2;s3;d4;d1s5;s5;s7;d8;s9;d10;d7s11;s10;/rC:;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C11H10N2 |
All Atoms: | 13 |
Heavy Atoms: | 13 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 6.93081 |
Area: | 341.791 |
Solvation: | -1.61397 |
Coulombic: | -22.7054 |
Bond Count [?]
All: | 14 |
Single: | 8 |
Double: | 6 |
Rotors: | 1 |
Chiral: | 0 |
Rigid Segments: | 2 |
Chemical Properties
Molecular Weight: | 170.211 |
H-Bond Donors: | 2 |
H-Bond Acceptors: | 1 |
XLogP: | 1.98 |
LogP (Chemaxon): | 2.03 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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