Chemical ID: 3999306

Cc1ccc(c(c1)C(C)N)C
Chemical ID:
3999306
Name [?]:
1-(2,5-dimethylphenyl)ethanamine
SMILES [?]:
Cc1ccc(c(c1)C(C)N)C
InChi [?]:
InChI=1/C10H15N/c1-7-4-5-8(2)10(6-7)9(3)11/h4-6,9H,11H2,1-3H3
InChi Info:
AuxInfo=1/0/N:1,11,9,3,4,7,2,5,8,6,10/rA:11cCCCCCCCCCNC/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;s8;s5;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H15N
All Atoms:11
Heavy Atoms:11
Chiral Atoms:1
ZAP Information [?]
Total:7.16853
Area:319.08
Solvation:-0.808473
Coulombic:-13.7761
Bond Count [?]
All:11
Single:8
Double:3
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:149.233
H-Bond Donors:2
H-Bond Acceptors:1
XLogP:2.54
LogP (Chemaxon):2.51

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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