N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-6-pyrazol-1-ylpyrazin-2-amine

C18H20N6O3S — CID 47053484

IUPACN-[(2-morpholin-4-ylsulfonylphenyl)methyl]-6-pyrazol-1-ylpyrazin-2-amine
SMILESO=S(=O)(c1ccccc1CNc1cncc(-n2cccn2)n1)N1CCOCC1
InChIInChI=1S/C18H20N6O3S/c25-28(26,23-8-10-27-11-9-23)16-5-2-1-4-15(16)12-20-17-13-19-14-18(22-17)24-7-3-6-21-24/h1-7,13-14H,8-12H2,(H,20,22)
InChIKeyFXFHZGPIRYXUGN-UHFFFAOYSA-N
MW400.46 g/mol
LogP1.30
Rot. Bonds6

About N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-6-pyrazol-1-ylpyrazin-2-amine

N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-6-pyrazol-1-ylpyrazin-2-amine (PubChem CID 47053484) has the molecular formula C18H20N6O3S and a molecular weight of 400.46 g/mol. Its IUPAC name is N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-6-pyrazol-1-ylpyrazin-2-amine.

Molecular Properties

Compound NameN-[(2-morpholin-4-ylsulfonylphenyl)methyl]-6-pyrazol-1-ylpyrazin-2-amine
PubChem CID47053484
Molecular FormulaC18H20N6O3S
Molecular Weight400.46 g/mol
Exact Mass400.13
IUPAC NameN-[(2-morpholin-4-ylsulfonylphenyl)methyl]-6-pyrazol-1-ylpyrazin-2-amine
SMILESO=S(=O)(c1ccccc1CNc1cncc(-n2cccn2)n1)N1CCOCC1
InChIInChI=1S/C18H20N6O3S/c25-28(26,23-8-10-27-11-9-23)16-5-2-1-4-15(16)12-20-17-13-19-14-18(22-17)24-7-3-6-21-24/h1-7,13-14H,8-12H2,(H,20,22)
InChIKeyFXFHZGPIRYXUGN-UHFFFAOYSA-N
XLogP1.30
TPSA102.24 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.46
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

N-[(2-morpholin-4-ylsulfonylphenyl)methyl]propan-2-amine
CID 60721221
N-[[2-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]-6-pyrazol-1-ylpyrazin-2-amine
CID 47054208
5-morpholin-4-ylsulfonyl-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]pyridin-2-amine
CID 55627000
N-[(2-ethoxy-3-pyridinyl)methyl]-6-pyrazol-1-ylpyrazin-2-amine
CID 47053568
N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-3-(1,2,4-triazol-1-yl)propanamide
CID 31515582
2-morpholin-4-ylsulfonyl-N-(pyridin-3-ylmethyl)benzamide
CID 31972800
2-methylsulfonyl-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-8-propan-2-ylpyrazolo[1,5-a][1,3,5]triazin-4-amine
CID 121257907
bis(4-(2-benzylphenyl)sulfonylmorpholine);sulfane
CID 68565404
6-methyl-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]pyridine-3-carboxamide
CID 18149126
2-chloro-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]pyridine-4-carboxamide
CID 33308662
6-methyl-N-[(2-piperidin-1-ylsulfonylphenyl)methyl]pyridin-2-amine
CID 133481721
2-(benzotriazol-1-yl)-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]acetamide
CID 24582303

Frequently Asked Questions

What is the IUPAC name of N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-6-pyrazol-1-ylpyrazin-2-amine?
The IUPAC name of N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-6-pyrazol-1-ylpyrazin-2-amine (CID 47053484) is N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-6-pyrazol-1-ylpyrazin-2-amine.
What is the SMILES notation for N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-6-pyrazol-1-ylpyrazin-2-amine?
The canonical SMILES for N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-6-pyrazol-1-ylpyrazin-2-amine is O=S(=O)(c1ccccc1CNc1cncc(-n2cccn2)n1)N1CCOCC1.
What is the InChIKey of N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-6-pyrazol-1-ylpyrazin-2-amine?
The InChIKey is FXFHZGPIRYXUGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N6O3S/c25-28(26,23-8-10-27-11-9-23)16-5-2-1-4-15(16)12-20-17-13-19-14-18(22-17)24-7-3-6-21-24/h1-7,13-14H,8-12H2,(H,20,22).
What are the key properties of N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-6-pyrazol-1-ylpyrazin-2-amine?
N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-6-pyrazol-1-ylpyrazin-2-amine has a molecular weight of 400.46 g/mol, XLogP of 1.30, 6 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-6-pyrazol-1-ylpyrazin-2-amine is sourced from PubChem (CID 47053484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).