Chemical ID: 7244434

CN(C1CCCc2c1cccc2)C(=O)CCl
Chemical ID:
7244434
Name [?]:
2-chloro-N-methyl-N-tetralin-1-yl-acetamide
SMILES [?]:
CN(C1CCCc2c1cccc2)C(=O)CCl
InChi [?]:
InChI=1/C13H16ClNO/c1-15(13(16)9-14)12-8-4-6-10-5-2-3-7-11(10)12/h2-3,5,7,12H,4,6,8-9H2,1H3
InChi Info:
AuxInfo=1/0/N:1,11,10,5,12,6,9,4,15,7,8,3,13,16,2,14/rA:16cCNCCCCCCCCCCCOCCl/rB:s1;s2;s3;s4;s5;s6;s3s7;d8;s9;d10;d7s11;s2;d13;s13;s15;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H16ClNO
All Atoms:32
Heavy Atoms:16
Chiral Atoms:1
ZAP Information [?]
Total:7.83262
Area:407.98
Solvation:-2.36688
Coulombic:-17.4971
Bond Count [?]
All:17
Single:13
Double:4
Rotors:3
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:237.725
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:2.67
LogP (Chemaxon):2.67

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Descriptor Annotations

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