6-[(2R)-4-(1-methylimidazol-4-yl)sulfonylmorpholin-2-yl]-N-pyridin-2-ylpyridin-3-amine

C18H20N6O3S — CID 124942643

IUPAC6-[(2R)-4-(1-methylimidazol-4-yl)sulfonylmorpholin-2-yl]-N-pyridin-2-ylpyridin-3-amine
SMILESCn1cnc(S(=O)(=O)N2CCO[C@@H](c3ccc(Nc4ccccn4)cn3)C2)c1
InChIInChI=1S/C18H20N6O3S/c1-23-12-18(21-13-23)28(25,26)24-8-9-27-16(11-24)15-6-5-14(10-20-15)22-17-4-2-3-7-19-17/h2-7,10,12-13,16H,8-9,11H2,1H3,(H,19,22)/t16-/m1/s1
InChIKeyAWRQMKKEAUYTCU-MRXNPFEDSA-N
MW400.46 g/mol
LogP1.72
Rot. Bonds5

About 6-[(2R)-4-(1-methylimidazol-4-yl)sulfonylmorpholin-2-yl]-N-pyridin-2-ylpyridin-3-amine

6-[(2R)-4-(1-methylimidazol-4-yl)sulfonylmorpholin-2-yl]-N-pyridin-2-ylpyridin-3-amine (PubChem CID 124942643) has the molecular formula C18H20N6O3S and a molecular weight of 400.46 g/mol. Its IUPAC name is 6-[(2R)-4-(1-methylimidazol-4-yl)sulfonylmorpholin-2-yl]-N-pyridin-2-ylpyridin-3-amine.

Molecular Properties

Compound Name6-[(2R)-4-(1-methylimidazol-4-yl)sulfonylmorpholin-2-yl]-N-pyridin-2-ylpyridin-3-amine
PubChem CID124942643
Molecular FormulaC18H20N6O3S
Molecular Weight400.46 g/mol
Exact Mass400.13
IUPAC Name6-[(2R)-4-(1-methylimidazol-4-yl)sulfonylmorpholin-2-yl]-N-pyridin-2-ylpyridin-3-amine
SMILESCn1cnc(S(=O)(=O)N2CCO[C@@H](c3ccc(Nc4ccccn4)cn3)C2)c1
InChIInChI=1S/C18H20N6O3S/c1-23-12-18(21-13-23)28(25,26)24-8-9-27-16(11-24)15-6-5-14(10-20-15)22-17-4-2-3-7-19-17/h2-7,10,12-13,16H,8-9,11H2,1H3,(H,19,22)/t16-/m1/s1
InChIKeyAWRQMKKEAUYTCU-MRXNPFEDSA-N
XLogP1.72
TPSA102.24 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.46
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

N,N-dimethyl-2-[5-(pyridin-2-ylamino)-2-pyridinyl]morpholine-4-sulfonamide
CID 127249076
6-[4-(3,4-dimethylphenyl)sulfonylmorpholin-2-yl]-N-pyridin-2-ylpyridin-3-amine
CID 127249177
6-[4-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]morpholin-2-yl]-N-pyridin-2-ylpyridin-3-amine
CID 127249216
N-(5-fluoro-2-pyridinyl)-6-[(2R)-4-(1-methylimidazol-4-yl)sulfonylmorpholin-2-yl]pyridin-2-amine
CID 124961644
methyl 2-[[6-[4-(1-methylimidazol-4-yl)sulfonylmorpholin-2-yl]-2-pyridinyl]amino]-1,3-thiazole-5-carboxylate
CID 132779801
(2S)-4-(1-methylimidazol-4-yl)sulfonyl-2-pyridin-4-ylmorpholine
CID 124953478
N-pyridin-2-yl-6-[(2R)-4-pyrimidin-2-ylmorpholin-2-yl]pyridin-3-amine
CID 124994337
6-[(2S)-4-[(1-methylpyrazol-4-yl)methyl]morpholin-2-yl]-N-pyridin-2-ylpyridin-3-amine
CID 124958285
N-(5-fluoro-2-pyridinyl)-6-[(2R)-1-(1-methylimidazol-4-yl)sulfonylpyrrolidin-2-yl]pyridin-3-amine
CID 95813512
1-[4-[(2R)-2-[5-(pyridin-2-ylamino)-2-pyridinyl]morpholine-4-carbonyl]piperidin-1-yl]ethanone
CID 124976016
N-methyl-6-[4-(1-methylpyrazol-4-yl)sulfonylmorpholin-2-yl]pyridin-3-amine
CID 110272045
4-(benzenesulfonyl)-2-pyridin-2-ylmorpholine
CID 110270736

Frequently Asked Questions

What is the IUPAC name of 6-[(2R)-4-(1-methylimidazol-4-yl)sulfonylmorpholin-2-yl]-N-pyridin-2-ylpyridin-3-amine?
The IUPAC name of 6-[(2R)-4-(1-methylimidazol-4-yl)sulfonylmorpholin-2-yl]-N-pyridin-2-ylpyridin-3-amine (CID 124942643) is 6-[(2R)-4-(1-methylimidazol-4-yl)sulfonylmorpholin-2-yl]-N-pyridin-2-ylpyridin-3-amine.
What is the SMILES notation for 6-[(2R)-4-(1-methylimidazol-4-yl)sulfonylmorpholin-2-yl]-N-pyridin-2-ylpyridin-3-amine?
The canonical SMILES for 6-[(2R)-4-(1-methylimidazol-4-yl)sulfonylmorpholin-2-yl]-N-pyridin-2-ylpyridin-3-amine is Cn1cnc(S(=O)(=O)N2CCO[C@@H](c3ccc(Nc4ccccn4)cn3)C2)c1.
What is the InChIKey of 6-[(2R)-4-(1-methylimidazol-4-yl)sulfonylmorpholin-2-yl]-N-pyridin-2-ylpyridin-3-amine?
The InChIKey is AWRQMKKEAUYTCU-MRXNPFEDSA-N. The full InChI is InChI=1S/C18H20N6O3S/c1-23-12-18(21-13-23)28(25,26)24-8-9-27-16(11-24)15-6-5-14(10-20-15)22-17-4-2-3-7-19-17/h2-7,10,12-13,16H,8-9,11H2,1H3,(H,19,22)/t16-/m1/s1.
What are the key properties of 6-[(2R)-4-(1-methylimidazol-4-yl)sulfonylmorpholin-2-yl]-N-pyridin-2-ylpyridin-3-amine?
6-[(2R)-4-(1-methylimidazol-4-yl)sulfonylmorpholin-2-yl]-N-pyridin-2-ylpyridin-3-amine has a molecular weight of 400.46 g/mol, XLogP of 1.72, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2R)-4-(1-methylimidazol-4-yl)sulfonylmorpholin-2-yl]-N-pyridin-2-ylpyridin-3-amine is sourced from PubChem (CID 124942643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).