Chemical ID: 5036555

Cc1cccc(c1)C(=O)N2CC2C
Chemical ID:
5036555
Name [?]:
(2-methylaziridin-1-yl)-(m-tolyl)methanone
SMILES [?]:
Cc1cccc(c1)C(=O)N2CC2C
InChi [?]:
InChI=1/C11H13NO/c1-8-4-3-5-10(6-8)11(13)12-7-9(12)2/h3-6,9H,7H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,13,4,3,5,7,11,2,12,6,8,10,9/rA:13cCCCCCCCCONCCC/rB:s1;s2;d3;s4;d5;d2s6;s6;d8;s8;s10;s10s11;s12;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H13NO
All Atoms:13
Heavy Atoms:13
Chiral Atoms:1
ZAP Information [?]
Total:7.09852
Area:357.11
Solvation:-1.82923
Coulombic:-18.2653
Bond Count [?]
All:14
Single:10
Double:4
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:175.227
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:2.26
LogP (Chemaxon):1.89

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Descriptor Annotations

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