Chemical ID: 5070007

Cc1cc(c(cc1C)C(C)N)C
Chemical ID:
5070007
Name [?]:
1-(2,4,5-trimethylphenyl)ethanamine
SMILES [?]:
Cc1cc(c(cc1C)C(C)N)C
InChi [?]:
InChI=1/C11H17N/c1-7-5-9(3)11(10(4)12)6-8(7)2/h5-6,10H,12H2,1-4H3
InChi Info:
AuxInfo=1/0/N:1,8,12,10,3,6,2,7,4,9,5,11/rA:12cCCCCCCCCCCNC/rB:s1;s2;d3;s4;d5;d2s6;s7;s5;s9;s9;s4;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H17N
All Atoms:12
Heavy Atoms:12
Chiral Atoms:1
ZAP Information [?]
Total:7.57032
Area:340.218
Solvation:-0.935125
Coulombic:-13.459
Bond Count [?]
All:12
Single:9
Double:3
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:163.259
H-Bond Donors:2
H-Bond Acceptors:1
XLogP:2.98
LogP (Chemaxon):2.98

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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