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Home > Indoles and Oxindole > 114085-90-4
114085-90-4 | 1H-Indole-6-carboxamide, N-(cyclopentylmethyl)-3-formyl-
CAS No: 114085-90-4 Catalog No: AG000AIZ MDL No:
Product Description
Catalog Number:
AG000AIZ
Chemical Name:
1H-Indole-6-carboxamide, N-(cyclopentylmethyl)-3-formyl-
CAS Number:
114085-90-4
Molecular Formula:
C16H18N2O2
Molecular Weight:
270.3263
IUPAC Name:
N-(cyclopentylmethyl)-3-formyl-1H-indole-6-carboxamide
InChI:
InChI=1S/C16H18N2O2/c19-10-13-9-17-15-7-12(5-6-14(13)15)16(20)18-8-11-3-1-2-4-11/h5-7,9-11,17H,1-4,8H2,(H,18,20)
InChI Key:
QDRJZYCSDKAXSN-UHFFFAOYSA-N
SMILES:
O=Cc1c[nH]c2c1ccc(c2)C(=O)NCC1CCCC1
Properties
Complexity:
366
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.137g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
270.332g/mol
Monoisotopic Mass:
270.137g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
62A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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