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Home > Indoles and Oxindole > 91100-15-1
91100-15-1 | 1H-Indole-2-carboxamide, N-(3-hydroxypropyl)-5-(oxiranylmethoxy)-
CAS No: 91100-15-1 Catalog No: AG006R1E MDL No:
Product Description
Catalog Number:
AG006R1E
Chemical Name:
1H-Indole-2-carboxamide, N-(3-hydroxypropyl)-5-(oxiranylmethoxy)-
CAS Number:
91100-15-1
Molecular Formula:
C15H18N2O4
Molecular Weight:
290.3144
IUPAC Name:
N-(3-hydroxypropyl)-5-(oxiran-2-ylmethoxy)-1H-indole-2-carboxamide
InChI:
InChI=1S/C15H18N2O4/c18-5-1-4-16-15(19)14-7-10-6-11(2-3-13(10)17-14)20-8-12-9-21-12/h2-3,6-7,12,17-18H,1,4-5,8-9H2,(H,16,19)
InChI Key:
FNDOCABOEKFUAG-UHFFFAOYSA-N
SMILES:
OCCCNC(=O)c1cc2c([nH]1)ccc(c2)OCC1CO1
Properties
Complexity:
366
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
290.127g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
290.319g/mol
Monoisotopic Mass:
290.127g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
86.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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