(Z)-N-(4-morpholin-4-ylsulfonylphenyl)-3-phenylprop-2-enamide

C19H20N2O4S — CID 2139660

IUPAC(Z)-N-(4-morpholin-4-ylsulfonylphenyl)-3-phenylprop-2-enamide
SMILESO=C(/C=C\c1ccccc1)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1
InChIInChI=1S/C19H20N2O4S/c22-19(11-6-16-4-2-1-3-5-16)20-17-7-9-18(10-8-17)26(23,24)21-12-14-25-15-13-21/h1-11H,12-15H2,(H,20,22)/b11-6-
InChIKeyHMTIRYWZBAFZDT-WDZFZDKYSA-N
MW372.45 g/mol
LogP2.36
Rot. Bonds5

About (Z)-N-(4-morpholin-4-ylsulfonylphenyl)-3-phenylprop-2-enamide

(Z)-N-(4-morpholin-4-ylsulfonylphenyl)-3-phenylprop-2-enamide (PubChem CID 2139660) has the molecular formula C19H20N2O4S and a molecular weight of 372.45 g/mol. Its IUPAC name is (Z)-N-(4-morpholin-4-ylsulfonylphenyl)-3-phenylprop-2-enamide.

Molecular Properties

Compound Name(Z)-N-(4-morpholin-4-ylsulfonylphenyl)-3-phenylprop-2-enamide
PubChem CID2139660
Molecular FormulaC19H20N2O4S
Molecular Weight372.45 g/mol
Exact Mass372.11
IUPAC Name(Z)-N-(4-morpholin-4-ylsulfonylphenyl)-3-phenylprop-2-enamide
SMILESO=C(/C=C\c1ccccc1)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1
InChIInChI=1S/C19H20N2O4S/c22-19(11-6-16-4-2-1-3-5-16)20-17-7-9-18(10-8-17)26(23,24)21-12-14-25-15-13-21/h1-11H,12-15H2,(H,20,22)/b11-6-
InChIKeyHMTIRYWZBAFZDT-WDZFZDKYSA-N
XLogP2.36
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.45
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

3-phenyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)prop-2-enamide
CID 1334857
N-(4-chlorophenyl)-3-(4-morpholin-4-ylsulfonylphenyl)prop-2-enamide
CID 71904513
(E)-N-(4-methylphenyl)-3-(4-morpholin-4-ylsulfonylphenyl)prop-2-enamide
CID 2664919
(E)-N-[4-(azepan-1-ylsulfonyl)phenyl]-3-phenylprop-2-enamide
CID 1185492
(E)-N-(4-morpholin-4-ylsulfonylphenyl)-3-(4-nitrophenyl)prop-2-enamide
CID 1108163
N-(4-morpholin-4-ylsulfonylphenyl)-3-(4-nitrophenyl)prop-2-enamide
CID 1108162
(Z)-4-(4-morpholin-4-ylsulfonylanilino)-4-oxobut-2-enoic acid
CID 2144801
(E)-3-(2-chlorophenyl)-N-(4-morpholin-4-ylsulfonylphenyl)prop-2-enamide
CID 1108161
(E)-N-(4-morpholin-4-ylsulfonylphenyl)-3-(2-nitrophenyl)prop-2-enamide
CID 1307715
N-(2-chlorophenyl)-3-(4-morpholin-4-ylsulfonylphenyl)prop-2-enamide
CID 71904558
(E)-N-[(4-morpholin-4-ylsulfonylphenyl)methyl]-3-phenylprop-2-enamide
CID 30505444
(E)-N-[4-(1,3-benzoxazol-2-yl)phenyl]-3-(4-morpholin-4-ylsulfonylphenyl)prop-2-enamide
CID 24599414

Frequently Asked Questions

What is the IUPAC name of (Z)-N-(4-morpholin-4-ylsulfonylphenyl)-3-phenylprop-2-enamide?
The IUPAC name of (Z)-N-(4-morpholin-4-ylsulfonylphenyl)-3-phenylprop-2-enamide (CID 2139660) is (Z)-N-(4-morpholin-4-ylsulfonylphenyl)-3-phenylprop-2-enamide.
What is the SMILES notation for (Z)-N-(4-morpholin-4-ylsulfonylphenyl)-3-phenylprop-2-enamide?
The canonical SMILES for (Z)-N-(4-morpholin-4-ylsulfonylphenyl)-3-phenylprop-2-enamide is O=C(/C=C\c1ccccc1)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1.
What is the InChIKey of (Z)-N-(4-morpholin-4-ylsulfonylphenyl)-3-phenylprop-2-enamide?
The InChIKey is HMTIRYWZBAFZDT-WDZFZDKYSA-N. The full InChI is InChI=1S/C19H20N2O4S/c22-19(11-6-16-4-2-1-3-5-16)20-17-7-9-18(10-8-17)26(23,24)21-12-14-25-15-13-21/h1-11H,12-15H2,(H,20,22)/b11-6-.
What are the key properties of (Z)-N-(4-morpholin-4-ylsulfonylphenyl)-3-phenylprop-2-enamide?
(Z)-N-(4-morpholin-4-ylsulfonylphenyl)-3-phenylprop-2-enamide has a molecular weight of 372.45 g/mol, XLogP of 2.36, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-(4-morpholin-4-ylsulfonylphenyl)-3-phenylprop-2-enamide is sourced from PubChem (CID 2139660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).