1H-pyrazol-5-yl-[2-(6-pyrimidin-5-yl-2-pyridinyl)morpholin-4-yl]methanone

C17H16N6O2 — CID 155983957

IUPAC1H-pyrazol-5-yl-[2-(6-pyrimidin-5-yl-2-pyridinyl)morpholin-4-yl]methanone
SMILESO=C(c1ccn[nH]1)N1CCOC(c2cccc(-c3cncnc3)n2)C1
InChIInChI=1S/C17H16N6O2/c24-17(15-4-5-20-22-15)23-6-7-25-16(10-23)14-3-1-2-13(21-14)12-8-18-11-19-9-12/h1-5,8-9,11,16H,6-7,10H2,(H,20,22)
InChIKeyFYXKBVNFELMVEX-UHFFFAOYSA-N
MW336.36 g/mol
LogP1.48
Rot. Bonds3

About 1H-pyrazol-5-yl-[2-(6-pyrimidin-5-yl-2-pyridinyl)morpholin-4-yl]methanone

1H-pyrazol-5-yl-[2-(6-pyrimidin-5-yl-2-pyridinyl)morpholin-4-yl]methanone (PubChem CID 155983957) has the molecular formula C17H16N6O2 and a molecular weight of 336.36 g/mol. Its IUPAC name is 1H-pyrazol-5-yl-[2-(6-pyrimidin-5-yl-2-pyridinyl)morpholin-4-yl]methanone.

Molecular Properties

Compound Name1H-pyrazol-5-yl-[2-(6-pyrimidin-5-yl-2-pyridinyl)morpholin-4-yl]methanone
PubChem CID155983957
Molecular FormulaC17H16N6O2
Molecular Weight336.36 g/mol
Exact Mass336.13
IUPAC Name1H-pyrazol-5-yl-[2-(6-pyrimidin-5-yl-2-pyridinyl)morpholin-4-yl]methanone
SMILESO=C(c1ccn[nH]1)N1CCOC(c2cccc(-c3cncnc3)n2)C1
InChIInChI=1S/C17H16N6O2/c24-17(15-4-5-20-22-15)23-6-7-25-16(10-23)14-3-1-2-13(21-14)12-8-18-11-19-9-12/h1-5,8-9,11,16H,6-7,10H2,(H,20,22)
InChIKeyFYXKBVNFELMVEX-UHFFFAOYSA-N
XLogP1.48
TPSA96.89 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.36
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 1H-pyrazol-5-yl-[2-(6-pyrimidin-5-yl-2-pyridinyl)morpholin-4-yl]methanone with MolForge

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Related Compounds

phenyl-[(2S)-2-(6-pyrimidin-5-yl-2-pyridinyl)morpholin-4-yl]methanone
CID 124940424
[2-(methylamino)-4-pyridinyl]-[(2R)-2-(6-pyrimidin-5-yl-2-pyridinyl)morpholin-4-yl]methanone
CID 125007616
[(2S)-2-(2-methylpyrimidin-4-yl)morpholin-4-yl]-(1H-pyrazol-5-yl)methanone
CID 124993182
[2-(hydroxymethyl)morpholin-4-yl]-(1H-pyrazol-5-yl)methanone
CID 81208376
4,6-dimethyl-1-[3-oxo-3-[2-(6-pyrimidin-5-yl-2-pyridinyl)morpholin-4-yl]propyl]pyrimidin-2-one
CID 127250547
[2-(chloromethyl)morpholin-4-yl]-(1H-pyrazol-5-yl)methanone
CID 81209890
(2-pyridin-2-ylmorpholin-4-yl)-pyrimidin-5-ylmethanone
CID 110270857
[2-[3-(difluoromethoxy)phenyl]morpholin-4-yl]-(1H-pyrazol-5-yl)methanone
CID 75391938
[(2R)-2-[6-(methylamino)-2-pyridinyl]morpholin-4-yl]-pyrimidin-5-ylmethanone
CID 124944788
[2-[6-(3,5-dimethyl-1,2-oxazol-4-yl)-2-pyridinyl]morpholin-4-yl]-pyrimidin-5-ylmethanone
CID 110135362
[2-(methylamino)-4-pyridinyl]-[(2S)-2-[6-(1H-pyrazol-4-yl)-2-pyridinyl]morpholin-4-yl]methanone
CID 124958881
4-[6-[(2S)-4-(4-fluorobenzoyl)morpholin-2-yl]-2-pyridinyl]benzamide
CID 124951464

Frequently Asked Questions

What is the IUPAC name of 1H-pyrazol-5-yl-[2-(6-pyrimidin-5-yl-2-pyridinyl)morpholin-4-yl]methanone?
The IUPAC name of 1H-pyrazol-5-yl-[2-(6-pyrimidin-5-yl-2-pyridinyl)morpholin-4-yl]methanone (CID 155983957) is 1H-pyrazol-5-yl-[2-(6-pyrimidin-5-yl-2-pyridinyl)morpholin-4-yl]methanone.
What is the SMILES notation for 1H-pyrazol-5-yl-[2-(6-pyrimidin-5-yl-2-pyridinyl)morpholin-4-yl]methanone?
The canonical SMILES for 1H-pyrazol-5-yl-[2-(6-pyrimidin-5-yl-2-pyridinyl)morpholin-4-yl]methanone is O=C(c1ccn[nH]1)N1CCOC(c2cccc(-c3cncnc3)n2)C1.
What is the InChIKey of 1H-pyrazol-5-yl-[2-(6-pyrimidin-5-yl-2-pyridinyl)morpholin-4-yl]methanone?
The InChIKey is FYXKBVNFELMVEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N6O2/c24-17(15-4-5-20-22-15)23-6-7-25-16(10-23)14-3-1-2-13(21-14)12-8-18-11-19-9-12/h1-5,8-9,11,16H,6-7,10H2,(H,20,22).
What are the key properties of 1H-pyrazol-5-yl-[2-(6-pyrimidin-5-yl-2-pyridinyl)morpholin-4-yl]methanone?
1H-pyrazol-5-yl-[2-(6-pyrimidin-5-yl-2-pyridinyl)morpholin-4-yl]methanone has a molecular weight of 336.36 g/mol, XLogP of 1.48, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1H-pyrazol-5-yl-[2-(6-pyrimidin-5-yl-2-pyridinyl)morpholin-4-yl]methanone is sourced from PubChem (CID 155983957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).