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Home > Indoles and Oxindole > 827316-81-4
827316-81-4 | 1H-Indole-5-carboxamide, N-cyclopentyl-2-(1H-pyrazol-3-yl)-
CAS No: 827316-81-4 Catalog No: AG004V54 MDL No:
Product Description
Catalog Number:
AG004V54
Chemical Name:
1H-Indole-5-carboxamide, N-cyclopentyl-2-(1H-pyrazol-3-yl)-
CAS Number:
827316-81-4
Molecular Formula:
C17H18N4O
Molecular Weight:
294.3510
IUPAC Name:
N-cyclopentyl-2-(1H-pyrazol-5-yl)-1H-indole-5-carboxamide
InChI:
InChI=1S/C17H18N4O/c22-17(19-13-3-1-2-4-13)11-5-6-14-12(9-11)10-16(20-14)15-7-8-18-21-15/h5-10,13,20H,1-4H2,(H,18,21)(H,19,22)
InChI Key:
BKXUFCJICCVZKC-UHFFFAOYSA-N
SMILES:
O=C(c1ccc2c(c1)cc([nH]2)c1n[nH]cc1)NC1CCCC1
Properties
Complexity:
410
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
294.148g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
294.358g/mol
Monoisotopic Mass:
294.148g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
73.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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