Chemical ID: 5009359

c1cc(cc(c1)Cl)CC2CCCN2
Chemical ID:
5009359
Name [?]:
2-[(3-chlorophenyl)methyl]pyrrolidine
SMILES [?]:
c1cc(cc(c1)Cl)CC2CCCN2
InChi [?]:
InChI=1/C11H14ClN/c12-10-4-1-3-9(7-10)8-11-5-2-6-13-11/h1,3-4,7,11,13H,2,5-6,8H2
InChi Info:
AuxInfo=1/0/N:1,11,2,6,10,12,4,8,3,5,9,7,13/rA:13cCCCCCCClCCCCCN/rB:s1;d2;s3;d4;d1s5;s5;s3;s8;s9;s10;s11;s9s12;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H14ClN
All Atoms:13
Heavy Atoms:13
Chiral Atoms:1
ZAP Information [?]
Total:8.37183
Area:370.197
Solvation:-0.883089
Coulombic:-10.8588
Bond Count [?]
All:14
Single:11
Double:3
Rotors:2
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:195.688
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:2.86
LogP (Chemaxon):2.74

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Descriptor Annotations

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