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Home > Indoles and Oxindole > 1170010-70-4
1170010-70-4 | (1-METHYL-2,3-DIHYDRO-1H-INDOL-5-YL)(MORPHOLIN-4-YL)ACETONITRILE
CAS No: 1170010-70-4 Catalog No: AG01ARNL MDL No:MFCD11987074
Product Description
Catalog Number:
AG01ARNL
Chemical Name:
(1-METHYL-2,3-DIHYDRO-1H-INDOL-5-YL)(MORPHOLIN-4-YL)ACETONITRILE
CAS Number:
1170010-70-4
Molecular Formula:
C15H19N3O
Molecular Weight:
257.3309
MDL Number:
MFCD11987074
IUPAC Name:
2-(1-methyl-2,3-dihydroindol-5-yl)-2-morpholin-4-ylacetonitrile
InChI:
InChI=1S/C15H19N3O/c1-17-5-4-13-10-12(2-3-14(13)17)15(11-16)18-6-8-19-9-7-18/h2-3,10,15H,4-9H2,1H3
InChI Key:
IPFDTMKTSNFTFD-UHFFFAOYSA-N
SMILES:
N#CC(c1ccc2c(c1)CCN2C)N1CCOCC1
Properties
Complexity:
358
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.153g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
257.337g/mol
Monoisotopic Mass:
257.153g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
39.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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