Chemical ID: 5113338

c1cc(ccc1C(CCO)N2CCCCC2)Cl
Chemical ID:
5113338
Name [?]:
3-(4-chlorophenyl)-3-(1-piperidyl)propan-1-ol
SMILES [?]:
c1cc(ccc1C(CCO)N2CCCCC2)Cl
InChi [?]:
InChI=1/C14H20ClNO/c15-13-6-4-12(5-7-13)14(8-11-17)16-9-2-1-3-10-16/h4-7,14,17H,1-3,8-11H2
InChi Info:
AuxInfo=1/0/N:14,13,15,1,5,2,4,8,12,16,9,6,3,7,17,11,10/E:(2,3)(4,5)(6,7)(9,10)/rA:17cCCCCCCCCCONCCCCCCl/rB:s1;d2;s3;d4;d1s5;s6;s7;s8;s9;s7;s11;s12;s13;s14;s11s15;s3;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H20ClNO
All Atoms:17
Heavy Atoms:17
Chiral Atoms:1
ZAP Information [?]
Total:8.84848
Area:443.641
Solvation:-2.24254
Coulombic:-23.8428
Bond Count [?]
All:18
Single:15
Double:3
Rotors:4
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:253.767
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:3.01
LogP (Chemaxon):2.85

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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