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81052-38-2 | 2-Propanol, 1-[(1H-indol-3-yl)oxy]-3-[(1-methylethyl)amino]-
CAS No: 81052-38-2 Catalog No: AG005HID MDL No:
Product Description
Catalog Number:
AG005HID
Chemical Name:
2-Propanol, 1-[(1H-indol-3-yl)oxy]-3-[(1-methylethyl)amino]-
CAS Number:
81052-38-2
Molecular Formula:
C14H20N2O2
Molecular Weight:
248.3208
IUPAC Name:
1-(1H-indol-3-yloxy)-3-(propan-2-ylamino)propan-2-ol
InChI:
InChI=1S/C14H20N2O2/c1-10(2)15-7-11(17)9-18-14-8-16-13-6-4-3-5-12(13)14/h3-6,8,10-11,15-17H,7,9H2,1-2H3
InChI Key:
YOOBDWKNYFLPMD-UHFFFAOYSA-N
SMILES:
OC(COc1c[nH]c2c1cccc2)CNC(C)C
Properties
Complexity:
248
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.152g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
248.326g/mol
Monoisotopic Mass:
248.152g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
57.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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