3-amino-N-(3-morpholin-4-ylsulfonylphenyl)-3-phenylpropanamide;hydrochloride

C19H24ClN3O4S — CID 119948702

IUPAC3-amino-N-(3-morpholin-4-ylsulfonylphenyl)-3-phenylpropanamide;hydrochloride
SMILESCl.NC(CC(=O)Nc1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccccc1
InChIInChI=1S/C19H23N3O4S.ClH/c20-18(15-5-2-1-3-6-15)14-19(23)21-16-7-4-8-17(13-16)27(24,25)22-9-11-26-12-10-22;/h1-8,13,18H,9-12,14,20H2,(H,21,23);1H
InChIKeyICIXDFASCOWWNZ-UHFFFAOYSA-N
MW425.94 g/mol
LogP2.16
Rot. Bonds6

About 3-amino-N-(3-morpholin-4-ylsulfonylphenyl)-3-phenylpropanamide;hydrochloride

3-amino-N-(3-morpholin-4-ylsulfonylphenyl)-3-phenylpropanamide;hydrochloride (PubChem CID 119948702) has the molecular formula C19H24ClN3O4S and a molecular weight of 425.94 g/mol. Its IUPAC name is 3-amino-N-(3-morpholin-4-ylsulfonylphenyl)-3-phenylpropanamide;hydrochloride.

Molecular Properties

Compound Name3-amino-N-(3-morpholin-4-ylsulfonylphenyl)-3-phenylpropanamide;hydrochloride
PubChem CID119948702
Molecular FormulaC19H24ClN3O4S
Molecular Weight425.94 g/mol
Exact Mass425.12
IUPAC Name3-amino-N-(3-morpholin-4-ylsulfonylphenyl)-3-phenylpropanamide;hydrochloride
SMILESCl.NC(CC(=O)Nc1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccccc1
InChIInChI=1S/C19H23N3O4S.ClH/c20-18(15-5-2-1-3-6-15)14-19(23)21-16-7-4-8-17(13-16)27(24,25)22-9-11-26-12-10-22;/h1-8,13,18H,9-12,14,20H2,(H,21,23);1H
InChIKeyICIXDFASCOWWNZ-UHFFFAOYSA-N
XLogP2.16
TPSA101.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500425.94
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-aminophenyl)-N-(3-morpholin-4-ylsulfonylphenyl)acetamide;hydrochloride
CID 119671802
(2S)-N-(3-morpholin-4-ylsulfonylphenyl)-2-phenylpentanamide
CID 7758976
2-amino-N-(3-morpholin-4-ylsulfonylphenyl)propanamide
CID 119262356
(3R)-3-phenyl-N-(3-pyrrolidin-1-ylsulfonylphenyl)butanamide
CID 7926305
2-amino-N-(3-morpholin-4-ylsulfonylphenyl)pentanamide
CID 119262364
7-amino-N-(3-morpholin-4-ylsulfonylphenyl)heptanamide
CID 119671799
N-[3-(3-morpholin-4-ylsulfonylanilino)-3-oxopropyl]benzamide
CID 8874279
N-(3-morpholin-4-ylsulfonylphenyl)-2-pyridin-2-ylsulfanylacetamide
CID 16530319
(2S)-2-(2-morpholin-4-ylethylamino)-N-(3-morpholin-4-ylsulfonylphenyl)-2-phenylacetamide
CID 30729039
[2-(3-morpholin-4-ylsulfonylanilino)-2-oxoethyl] cyclopropanecarboxylate
CID 3569637
2-(4-chlorophenyl)sulfanyl-N-(3-morpholin-4-ylsulfonylphenyl)acetamide
CID 3424032
(2R)-N,N-dimethyl-2-[(3-morpholin-4-ylsulfonylphenyl)carbamoylamino]-2-phenylacetamide
CID 52522864

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(3-morpholin-4-ylsulfonylphenyl)-3-phenylpropanamide;hydrochloride?
The IUPAC name of 3-amino-N-(3-morpholin-4-ylsulfonylphenyl)-3-phenylpropanamide;hydrochloride (CID 119948702) is 3-amino-N-(3-morpholin-4-ylsulfonylphenyl)-3-phenylpropanamide;hydrochloride.
What is the SMILES notation for 3-amino-N-(3-morpholin-4-ylsulfonylphenyl)-3-phenylpropanamide;hydrochloride?
The canonical SMILES for 3-amino-N-(3-morpholin-4-ylsulfonylphenyl)-3-phenylpropanamide;hydrochloride is Cl.NC(CC(=O)Nc1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccccc1.
What is the InChIKey of 3-amino-N-(3-morpholin-4-ylsulfonylphenyl)-3-phenylpropanamide;hydrochloride?
The InChIKey is ICIXDFASCOWWNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O4S.ClH/c20-18(15-5-2-1-3-6-15)14-19(23)21-16-7-4-8-17(13-16)27(24,25)22-9-11-26-12-10-22;/h1-8,13,18H,9-12,14,20H2,(H,21,23);1H.
What are the key properties of 3-amino-N-(3-morpholin-4-ylsulfonylphenyl)-3-phenylpropanamide;hydrochloride?
3-amino-N-(3-morpholin-4-ylsulfonylphenyl)-3-phenylpropanamide;hydrochloride has a molecular weight of 425.94 g/mol, XLogP of 2.16, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(3-morpholin-4-ylsulfonylphenyl)-3-phenylpropanamide;hydrochloride is sourced from PubChem (CID 119948702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).