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Chemical ID: 7509080
Chemical ID:
7509080
Name [?]:
N-(cyclopropylmethyl)-N-(4-pyridylmethyl)propan-1-amine
SMILES [?]:
CCCN(Cc1ccncc1)CC2CC2
InChi [?]:
InChI=1/C13H20N2/c1-2-9-15(10-12-3-4-12)11-13-5-7-14-8-6-13/h5-8,12H,2-4,9-11H2,1H3
InChi Info:
AuxInfo=1/0/N:1,2,14,15,7,11,8,10,3,12,5,13,6,9,4/E:(3,4)(5,6)(7,8)/rA:15cCCCNCCCCNCCCCCC/rB:s1;s2;s3;s4;s5;s6;d7;s8;d9;d6s10;s4;s12;s13;s13s14;/rC:;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C13H20N2 |
All Atoms: | 35 |
Heavy Atoms: | 15 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 8.36329 |
Area: | 404.299 |
Solvation: | -1.74418 |
Coulombic: | -10.4815 |
Bond Count [?]
All: | 16 |
Single: | 13 |
Double: | 3 |
Rotors: | 6 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 2.04 |
LogP (Chemaxon): | None |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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