Chemical ID: 4253578

c1ccc(c(c1)CC2CCNC2)Cl
Chemical ID:
4253578
Name [?]:
3-[(2-chlorophenyl)methyl]pyrrolidine
SMILES [?]:
c1ccc(c(c1)CC2CCNC2)Cl
InChi [?]:
InChI=1/C11H14ClN/c12-11-4-2-1-3-10(11)7-9-5-6-13-8-9/h1-4,9,13H,5-8H2
InChi Info:
AuxInfo=1/0/N:1,2,6,3,9,10,7,12,8,5,4,13,11/rA:13cCCCCCCCCCCNCCl/rB:s1;d2;s3;d4;d1s5;s5;s7;s8;s9;s10;s8s11;s4;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H14ClN
All Atoms:13
Heavy Atoms:13
Chiral Atoms:1
ZAP Information [?]
Total:8.05288
Area:359.766
Solvation:-0.941276
Coulombic:-11.1571
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:2.69
LogP (Chemaxon):2.66

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Descriptor Annotations

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