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Chemical ID: 5011687
Chemical ID:
5011687
Name [?]:
2-(1-naphthyl)piperidine
SMILES [?]:
c1ccc2c(c1)cccc2C3CCCCN3
InChi [?]:
InChI=1/C15H17N/c1-2-8-13-12(6-1)7-5-9-14(13)15-10-3-4-11-16-15/h1-2,5-9,15-16H,3-4,10-11H2
InChi Info:
AuxInfo=1/0/N:1,2,13,14,8,6,7,3,9,12,15,5,4,10,11,16/rA:16cCCCCCCCCCCCCCCCN/rB:s1;d2;s3;s4;d1s5;d5;s7;d8;d4s9;s10;s11;s12;s13;s14;s11s15;/rC:;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C15H17N |
All Atoms: | 16 |
Heavy Atoms: | 16 |
Chiral Atoms: | 1 |
ZAP Information [?]
Total: | 8.48557 |
Area: | 381.679 |
Solvation: | -1.05642 |
Coulombic: | -11.785 |
Bond Count [?]
All: | 18 |
Single: | 13 |
Double: | 5 |
Rotors: | 1 |
Chiral: | 0 |
Rigid Segments: | 2 |
Chemical Properties
Molecular Weight: | 211.302 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 1 |
XLogP: | 3.77 |
LogP (Chemaxon): | 3.37 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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