N-[6-[4-[(2-chlorophenyl)methylsulfonyl]morpholin-2-yl]-2-pyridinyl]pyrazin-2-amine

C20H20ClN5O3S — CID 110093032

IUPACN-[6-[4-[(2-chlorophenyl)methylsulfonyl]morpholin-2-yl]-2-pyridinyl]pyrazin-2-amine
SMILESO=S(=O)(Cc1ccccc1Cl)N1CCOC(c2cccc(Nc3cnccn3)n2)C1
InChIInChI=1S/C20H20ClN5O3S/c21-16-5-2-1-4-15(16)14-30(27,28)26-10-11-29-18(13-26)17-6-3-7-19(24-17)25-20-12-22-8-9-23-20/h1-9,12,18H,10-11,13-14H2,(H,23,24,25)
InChIKeyRBLUIIGNSPMMCZ-UHFFFAOYSA-N
MW445.93 g/mol
LogP3.17
Rot. Bonds6

About N-[6-[4-[(2-chlorophenyl)methylsulfonyl]morpholin-2-yl]-2-pyridinyl]pyrazin-2-amine

N-[6-[4-[(2-chlorophenyl)methylsulfonyl]morpholin-2-yl]-2-pyridinyl]pyrazin-2-amine (PubChem CID 110093032) has the molecular formula C20H20ClN5O3S and a molecular weight of 445.93 g/mol. Its IUPAC name is N-[6-[4-[(2-chlorophenyl)methylsulfonyl]morpholin-2-yl]-2-pyridinyl]pyrazin-2-amine.

Molecular Properties

Compound NameN-[6-[4-[(2-chlorophenyl)methylsulfonyl]morpholin-2-yl]-2-pyridinyl]pyrazin-2-amine
PubChem CID110093032
Molecular FormulaC20H20ClN5O3S
Molecular Weight445.93 g/mol
Exact Mass445.10
IUPAC NameN-[6-[4-[(2-chlorophenyl)methylsulfonyl]morpholin-2-yl]-2-pyridinyl]pyrazin-2-amine
SMILESO=S(=O)(Cc1ccccc1Cl)N1CCOC(c2cccc(Nc3cnccn3)n2)C1
InChIInChI=1S/C20H20ClN5O3S/c21-16-5-2-1-4-15(16)14-30(27,28)26-10-11-29-18(13-26)17-6-3-7-19(24-17)25-20-12-22-8-9-23-20/h1-9,12,18H,10-11,13-14H2,(H,23,24,25)
InChIKeyRBLUIIGNSPMMCZ-UHFFFAOYSA-N
XLogP3.17
TPSA97.31 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500445.93
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-[6-[(2R)-4-(2-chlorophenyl)sulfonylmorpholin-2-yl]-2-pyridinyl]pyrazin-2-amine
CID 124974476
6-[(2R)-4-[(2-chlorophenyl)methyl]morpholin-2-yl]-N-pyridin-2-ylpyridin-2-amine
CID 124980334
(2R)-4-benzylsulfonyl-2-pyrazin-2-ylmorpholine
CID 124960005
(2S)-4-benzylsulfonyl-2-pyrazin-2-ylmorpholine
CID 124960004
(2S)-4-[(2-chlorophenyl)methylsulfonyl]-2-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)morpholine
CID 97344782
4-[(2-chlorophenyl)methylsulfonyl]-2-(4-methoxyphenyl)morpholine
CID 110327273
4-[(2-chlorophenyl)methylsulfonyl]-2-methylmorpholine
CID 110292466
6-[(2R)-4-(2-chlorophenyl)sulfonylmorpholin-2-yl]-N-pyrimidin-2-ylpyrazin-2-amine
CID 124996771
N-[6-[(2S)-morpholin-2-yl]-2-pyridinyl]pyrazin-2-amine
CID 124999103
3-(1,3-benzothiazol-2-yl)-1-[(2S)-2-[6-(pyrazin-2-ylamino)-2-pyridinyl]morpholin-4-yl]propan-1-one
CID 124965421
N-[6-[4-(2,3-dichlorophenyl)sulfonylmorpholin-2-yl]-2-pyridinyl]-5-methyl-1,3-thiazol-2-amine
CID 155985038
6-[4-[(2-chlorophenyl)methyl]morpholin-2-yl]-N-pyrimidin-2-ylpyrazin-2-amine
CID 127251749

Frequently Asked Questions

What is the IUPAC name of N-[6-[4-[(2-chlorophenyl)methylsulfonyl]morpholin-2-yl]-2-pyridinyl]pyrazin-2-amine?
The IUPAC name of N-[6-[4-[(2-chlorophenyl)methylsulfonyl]morpholin-2-yl]-2-pyridinyl]pyrazin-2-amine (CID 110093032) is N-[6-[4-[(2-chlorophenyl)methylsulfonyl]morpholin-2-yl]-2-pyridinyl]pyrazin-2-amine.
What is the SMILES notation for N-[6-[4-[(2-chlorophenyl)methylsulfonyl]morpholin-2-yl]-2-pyridinyl]pyrazin-2-amine?
The canonical SMILES for N-[6-[4-[(2-chlorophenyl)methylsulfonyl]morpholin-2-yl]-2-pyridinyl]pyrazin-2-amine is O=S(=O)(Cc1ccccc1Cl)N1CCOC(c2cccc(Nc3cnccn3)n2)C1.
What is the InChIKey of N-[6-[4-[(2-chlorophenyl)methylsulfonyl]morpholin-2-yl]-2-pyridinyl]pyrazin-2-amine?
The InChIKey is RBLUIIGNSPMMCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20ClN5O3S/c21-16-5-2-1-4-15(16)14-30(27,28)26-10-11-29-18(13-26)17-6-3-7-19(24-17)25-20-12-22-8-9-23-20/h1-9,12,18H,10-11,13-14H2,(H,23,24,25).
What are the key properties of N-[6-[4-[(2-chlorophenyl)methylsulfonyl]morpholin-2-yl]-2-pyridinyl]pyrazin-2-amine?
N-[6-[4-[(2-chlorophenyl)methylsulfonyl]morpholin-2-yl]-2-pyridinyl]pyrazin-2-amine has a molecular weight of 445.93 g/mol, XLogP of 3.17, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-[4-[(2-chlorophenyl)methylsulfonyl]morpholin-2-yl]-2-pyridinyl]pyrazin-2-amine is sourced from PubChem (CID 110093032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).