Chemical ID: 3965049

c1cc2c(cc1C(=O)N)c(c[nH]2)CCN
Chemical ID:
3965049
Name [?]:
3-(2-aminoethyl)-1H-indole-5-carboxamide
SMILES [?]:
c1cc2c(cc1C(=O)N)c(c[nH]2)CCN
InChi [?]:
InChI=1/C11H13N3O/c12-4-3-8-6-14-10-2-1-7(11(13)15)5-9(8)10/h1-2,5-6,14H,3-4,12H2,(H2,13,15)
InChi Info:
AuxInfo=1/1/N:1,2,13,14,5,11,6,10,4,3,7,15,9,12,8/rA:15nCCCCCCCONCCNCCN/rB:s1;d2;s3;d4;d1s5;s6;d7;s7;s4;d10;s3s11;s10;s13;s14;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H13N3O
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:7.38469
Area:386.445
Solvation:-2.27645
Coulombic:-48.8558
Bond Count [?]
All:16
Single:11
Double:5
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:203.241
H-Bond Donors:4
H-Bond Acceptors:3
XLogP:0.26
LogP (Chemaxon):0.47

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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