[2-(methylamino)-4-pyridinyl]-[(2S)-2-[6-(1H-pyrazol-4-yl)-2-pyridinyl]morpholin-4-yl]methanone

C19H20N6O2 — CID 124958881

IUPAC[2-(methylamino)-4-pyridinyl]-[(2S)-2-[6-(1H-pyrazol-4-yl)-2-pyridinyl]morpholin-4-yl]methanone
SMILESCNc1cc(C(=O)N2CCO[C@H](c3cccc(-c4cn[nH]c4)n3)C2)ccn1
InChIInChI=1S/C19H20N6O2/c1-20-18-9-13(5-6-21-18)19(26)25-7-8-27-17(12-25)16-4-2-3-15(24-16)14-10-22-23-11-14/h2-6,9-11,17H,7-8,12H2,1H3,(H,20,21)(H,22,23)/t17-/m0/s1
InChIKeyGJHHMTSAJIQUOK-KRWDZBQOSA-N
MW364.41 g/mol
LogP2.12
Rot. Bonds4

About [2-(methylamino)-4-pyridinyl]-[(2S)-2-[6-(1H-pyrazol-4-yl)-2-pyridinyl]morpholin-4-yl]methanone

[2-(methylamino)-4-pyridinyl]-[(2S)-2-[6-(1H-pyrazol-4-yl)-2-pyridinyl]morpholin-4-yl]methanone (PubChem CID 124958881) has the molecular formula C19H20N6O2 and a molecular weight of 364.41 g/mol. Its IUPAC name is [2-(methylamino)-4-pyridinyl]-[(2S)-2-[6-(1H-pyrazol-4-yl)-2-pyridinyl]morpholin-4-yl]methanone.

Molecular Properties

Compound Name[2-(methylamino)-4-pyridinyl]-[(2S)-2-[6-(1H-pyrazol-4-yl)-2-pyridinyl]morpholin-4-yl]methanone
PubChem CID124958881
Molecular FormulaC19H20N6O2
Molecular Weight364.41 g/mol
Exact Mass364.16
IUPAC Name[2-(methylamino)-4-pyridinyl]-[(2S)-2-[6-(1H-pyrazol-4-yl)-2-pyridinyl]morpholin-4-yl]methanone
SMILESCNc1cc(C(=O)N2CCO[C@H](c3cccc(-c4cn[nH]c4)n3)C2)ccn1
InChIInChI=1S/C19H20N6O2/c1-20-18-9-13(5-6-21-18)19(26)25-7-8-27-17(12-25)16-4-2-3-15(24-16)14-10-22-23-11-14/h2-6,9-11,17H,7-8,12H2,1H3,(H,20,21)(H,22,23)/t17-/m0/s1
InChIKeyGJHHMTSAJIQUOK-KRWDZBQOSA-N
XLogP2.12
TPSA96.03 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.41
LogP ≤ 52.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze [2-(methylamino)-4-pyridinyl]-[(2S)-2-[6-(1H-pyrazol-4-yl)-2-pyridinyl]morpholin-4-yl]methanone with MolForge

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Related Compounds

[2-(methylamino)-4-pyridinyl]-[(2R)-2-(6-pyrimidin-5-yl-2-pyridinyl)morpholin-4-yl]methanone
CID 125007616
[(2S)-2-[6-[(4-ethoxyphenyl)methyl]-2-pyridinyl]morpholin-4-yl]-[2-(methylamino)-4-pyridinyl]methanone
CID 125020350
N-methyl-5-[2-methyl-6-[4-[2-(methylamino)pyridine-4-carbonyl]morpholin-2-yl]-4-pyridinyl]pyridine-2-carboxamide
CID 110130769
[2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]-[2-(methylamino)-4-pyridinyl]methanone
CID 56874345
[(2R)-2-[6-(methylamino)-2-pyridinyl]morpholin-4-yl]-pyrimidin-5-ylmethanone
CID 124944788
2-[(2S)-4-[2-(methylamino)pyridine-4-carbonyl]morpholin-2-yl]-N-propan-2-ylquinoline-4-carboxamide
CID 92639143
2-[(2R)-4-[2-(methylamino)pyridine-4-carbonyl]morpholin-2-yl]-N-propan-2-ylquinoline-4-carboxamide
CID 92639142
[3-(methoxymethyl)phenyl]-[(2R)-2-[6-(methylamino)-2-pyridinyl]morpholin-4-yl]methanone
CID 124952972
[3-(1H-pyrazol-4-yl)phenyl]-[(2R)-2-(trifluoromethyl)morpholin-4-yl]methanone
CID 95549395
(5-tert-butyl-1H-pyrazol-3-yl)-[(2R)-2-[6-(methylamino)-2-pyridinyl]morpholin-4-yl]methanone
CID 124992900
phenyl-[(2S)-2-(6-pyrimidin-5-yl-2-pyridinyl)morpholin-4-yl]methanone
CID 124940424
[2-(methylamino)-4-pyridinyl]-(3-methylpyrrolidin-1-yl)methanone
CID 62181147

Frequently Asked Questions

What is the IUPAC name of [2-(methylamino)-4-pyridinyl]-[(2S)-2-[6-(1H-pyrazol-4-yl)-2-pyridinyl]morpholin-4-yl]methanone?
The IUPAC name of [2-(methylamino)-4-pyridinyl]-[(2S)-2-[6-(1H-pyrazol-4-yl)-2-pyridinyl]morpholin-4-yl]methanone (CID 124958881) is [2-(methylamino)-4-pyridinyl]-[(2S)-2-[6-(1H-pyrazol-4-yl)-2-pyridinyl]morpholin-4-yl]methanone.
What is the SMILES notation for [2-(methylamino)-4-pyridinyl]-[(2S)-2-[6-(1H-pyrazol-4-yl)-2-pyridinyl]morpholin-4-yl]methanone?
The canonical SMILES for [2-(methylamino)-4-pyridinyl]-[(2S)-2-[6-(1H-pyrazol-4-yl)-2-pyridinyl]morpholin-4-yl]methanone is CNc1cc(C(=O)N2CCO[C@H](c3cccc(-c4cn[nH]c4)n3)C2)ccn1.
What is the InChIKey of [2-(methylamino)-4-pyridinyl]-[(2S)-2-[6-(1H-pyrazol-4-yl)-2-pyridinyl]morpholin-4-yl]methanone?
The InChIKey is GJHHMTSAJIQUOK-KRWDZBQOSA-N. The full InChI is InChI=1S/C19H20N6O2/c1-20-18-9-13(5-6-21-18)19(26)25-7-8-27-17(12-25)16-4-2-3-15(24-16)14-10-22-23-11-14/h2-6,9-11,17H,7-8,12H2,1H3,(H,20,21)(H,22,23)/t17-/m0/s1.
What are the key properties of [2-(methylamino)-4-pyridinyl]-[(2S)-2-[6-(1H-pyrazol-4-yl)-2-pyridinyl]morpholin-4-yl]methanone?
[2-(methylamino)-4-pyridinyl]-[(2S)-2-[6-(1H-pyrazol-4-yl)-2-pyridinyl]morpholin-4-yl]methanone has a molecular weight of 364.41 g/mol, XLogP of 2.12, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(methylamino)-4-pyridinyl]-[(2S)-2-[6-(1H-pyrazol-4-yl)-2-pyridinyl]morpholin-4-yl]methanone is sourced from PubChem (CID 124958881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).