N-(4-morpholin-4-ylsulfonylphenyl)-2-(5-pyridin-4-ylpyrazol-1-yl)acetamide

C20H21N5O4S — CID 56539574

IUPACN-(4-morpholin-4-ylsulfonylphenyl)-2-(5-pyridin-4-ylpyrazol-1-yl)acetamide
SMILESO=C(Cn1nccc1-c1ccncc1)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1
InChIInChI=1S/C20H21N5O4S/c26-20(15-25-19(7-10-22-25)16-5-8-21-9-6-16)23-17-1-3-18(4-2-17)30(27,28)24-11-13-29-14-12-24/h1-10H,11-15H2,(H,23,26)
InChIKeyGADOGARURPYOMP-UHFFFAOYSA-N
MW427.49 g/mol
LogP1.60
Rot. Bonds6

About N-(4-morpholin-4-ylsulfonylphenyl)-2-(5-pyridin-4-ylpyrazol-1-yl)acetamide

N-(4-morpholin-4-ylsulfonylphenyl)-2-(5-pyridin-4-ylpyrazol-1-yl)acetamide (PubChem CID 56539574) has the molecular formula C20H21N5O4S and a molecular weight of 427.49 g/mol. Its IUPAC name is N-(4-morpholin-4-ylsulfonylphenyl)-2-(5-pyridin-4-ylpyrazol-1-yl)acetamide.

Molecular Properties

Compound NameN-(4-morpholin-4-ylsulfonylphenyl)-2-(5-pyridin-4-ylpyrazol-1-yl)acetamide
PubChem CID56539574
Molecular FormulaC20H21N5O4S
Molecular Weight427.49 g/mol
Exact Mass427.13
IUPAC NameN-(4-morpholin-4-ylsulfonylphenyl)-2-(5-pyridin-4-ylpyrazol-1-yl)acetamide
SMILESO=C(Cn1nccc1-c1ccncc1)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1
InChIInChI=1S/C20H21N5O4S/c26-20(15-25-19(7-10-22-25)16-5-8-21-9-6-16)23-17-1-3-18(4-2-17)30(27,28)24-11-13-29-14-12-24/h1-10H,11-15H2,(H,23,26)
InChIKeyGADOGARURPYOMP-UHFFFAOYSA-N
XLogP1.60
TPSA106.42 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500427.49
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-(4-morpholin-4-ylsulfonylphenyl)propanamide
CID 832676
4-[4-[2-(5-pyridin-4-ylpyrazol-1-yl)ethoxy]phenyl]sulfonylmorpholine
CID 56539542
2-[3,5-bis(difluoromethyl)pyrazol-1-yl]-N-(4-morpholin-4-ylsulfonylphenyl)acetamide
CID 4765482
2-(4-chloro-3,5-dimethylpyrazol-1-yl)-N-(4-morpholin-4-ylsulfonylphenyl)acetamide
CID 19525215
N,N'-bis(4-morpholin-4-ylsulfonylphenyl)decanediamide
CID 17080112
2-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(4-morpholin-4-ylsulfonylphenyl)acetamide
CID 19519155
N-(4-morpholin-4-ylsulfonylphenyl)butanamide
CID 832695
2-[(4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-N-(4-morpholin-4-ylsulfonylphenyl)acetamide
CID 11931060
2-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-(4-morpholin-4-ylsulfonylphenyl)acetamide
CID 19515729
2-(4-methylpiperidin-1-yl)-N-(4-morpholin-4-ylsulfonylphenyl)acetamide
CID 1152713
2-(3,5-dimethylpiperidin-1-yl)-N-(4-morpholin-4-ylsulfonylphenyl)acetamide
CID 4278623
2-(2,6-dimethyl-4-oxo-1-pyridinyl)-N-(4-morpholin-4-ylsulfonylphenyl)acetamide
CID 108806474

Frequently Asked Questions

What is the IUPAC name of N-(4-morpholin-4-ylsulfonylphenyl)-2-(5-pyridin-4-ylpyrazol-1-yl)acetamide?
The IUPAC name of N-(4-morpholin-4-ylsulfonylphenyl)-2-(5-pyridin-4-ylpyrazol-1-yl)acetamide (CID 56539574) is N-(4-morpholin-4-ylsulfonylphenyl)-2-(5-pyridin-4-ylpyrazol-1-yl)acetamide.
What is the SMILES notation for N-(4-morpholin-4-ylsulfonylphenyl)-2-(5-pyridin-4-ylpyrazol-1-yl)acetamide?
The canonical SMILES for N-(4-morpholin-4-ylsulfonylphenyl)-2-(5-pyridin-4-ylpyrazol-1-yl)acetamide is O=C(Cn1nccc1-c1ccncc1)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1.
What is the InChIKey of N-(4-morpholin-4-ylsulfonylphenyl)-2-(5-pyridin-4-ylpyrazol-1-yl)acetamide?
The InChIKey is GADOGARURPYOMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N5O4S/c26-20(15-25-19(7-10-22-25)16-5-8-21-9-6-16)23-17-1-3-18(4-2-17)30(27,28)24-11-13-29-14-12-24/h1-10H,11-15H2,(H,23,26).
What are the key properties of N-(4-morpholin-4-ylsulfonylphenyl)-2-(5-pyridin-4-ylpyrazol-1-yl)acetamide?
N-(4-morpholin-4-ylsulfonylphenyl)-2-(5-pyridin-4-ylpyrazol-1-yl)acetamide has a molecular weight of 427.49 g/mol, XLogP of 1.60, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-morpholin-4-ylsulfonylphenyl)-2-(5-pyridin-4-ylpyrazol-1-yl)acetamide is sourced from PubChem (CID 56539574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).