4-methanesulfonyl-3-(morpholin-4-yl)aniline

4-methanesulfonyl-3-(morpholin-4-yl)aniline

CAS: 942474-45-5

Formula: C11H16N2O3S

SMILES: CS(=O)(=O)C1=C(C=C(N)C=C1)N1CCOCC1

IUPAC: 4-methanesulfonyl-3-(morpholin-4-yl)aniline

InChI: InChI=1S/C11H16N2O3S/c1-17(14,15)11-3-2-9(12)8-10(11)13-4-6-16-7-5-13/h2-3,8H,4-7,12H2,1H3

Composition: C (51.55%), H (6.29%), N (10.93%), O (18.73%), S (12.51%)

Molar Mass: 256.32

Atom Count: 33

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	256.088163557
Formal Charge	0
FSP3	0.45
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	QBRJRTMDHUKPIL-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	68.27
Topological Polar Surface Area	72.63
Polarizability	25.96
Ring Count	2
Rotatable Bond Count	2

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