Chemical ID: 4727543

c1ccc2c(c1)c(c[nH]2)CN
Chemical ID:
4727543
Name [?]:
1H-indol-3-ylmethanamine
SMILES [?]:
c1ccc2c(c1)c(c[nH]2)CN
InChi [?]:
InChI=1/C9H10N2/c10-5-7-6-11-9-4-2-1-3-8(7)9/h1-4,6,11H,5,10H2
InChi Info:
AuxInfo=1/0/N:1,2,6,3,10,8,7,5,4,11,9/rA:11nCCCCCCCCNCN/rB:s1;d2;s3;d4;d1s5;s5;d7;s4s8;s7;s10;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C9H10N2
All Atoms:11
Heavy Atoms:11
Chiral Atoms:0
ZAP Information [?]
Total:6.22111
Area:304.581
Solvation:-1.39343
Coulombic:-23.8399
Bond Count [?]
All:12
Single:8
Double:4
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:146.189
H-Bond Donors:2
H-Bond Acceptors:1
XLogP:1.22
LogP (Chemaxon):1.57

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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