Chemical ID: 6664293

CC(Cc1ccc(cc1)Cl)NCC2CC2
Chemical ID:
6664293
Name [?]:
1-(4-chlorophenyl)-N-(cyclopropylmethyl)propan-2-amine
SMILES [?]:
CC(Cc1ccc(cc1)Cl)NCC2CC2
InChi [?]:
InChI=1/C13H18ClN/c1-10(15-9-12-2-3-12)8-11-4-6-13(14)7-5-11/h4-7,10,12,15H,2-3,8-9H2,1H3
InChi Info:
AuxInfo=1/0/N:1,14,15,5,9,6,8,3,12,2,4,13,7,10,11/E:(2,3)(4,5)(6,7)/rA:15cCCCCCCCCCClNCCCC/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s7;s2;s11;s12;s13;s13s14;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H18ClN
All Atoms:15
Heavy Atoms:15
Chiral Atoms:1
ZAP Information [?]
Total:9.82102
Area:429.298
Solvation:-0.91143
Coulombic:-11.4489
Bond Count [?]
All:16
Single:13
Double:3
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:223.741
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:3.51
LogP (Chemaxon):3.46

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Descriptor Annotations

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