Chemical ID: 4253487

c1ccc(c(c1)CC2CCCNC2)Cl
Chemical ID:
4253487
Name [?]:
3-[(2-chlorophenyl)methyl]piperidine
SMILES [?]:
c1ccc(c(c1)CC2CCCNC2)Cl
InChi [?]:
InChI=1/C12H16ClN/c13-12-6-2-1-5-11(12)8-10-4-3-7-14-9-10/h1-2,5-6,10,14H,3-4,7-9H2
InChi Info:
AuxInfo=1/0/N:1,2,10,9,6,3,11,7,13,8,5,4,14,12/rA:14cCCCCCCCCCCCNCCl/rB:s1;d2;s3;d4;d1s5;s5;s7;s8;s9;s10;s11;s8s12;s4;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H16ClN
All Atoms:14
Heavy Atoms:14
Chiral Atoms:1
ZAP Information [?]
Total:8.41761
Area:376.352
Solvation:-0.991198
Coulombic:-11.3371
Bond Count [?]
All:15
Single:12
Double:3
Rotors:2
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:209.715
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:3.05
LogP (Chemaxon):3.05

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Descriptor Annotations

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