4-[6-[3-(3-methoxyphenyl)pyrazol-1-yl]pyrimidin-4-yl]morpholine

C18H19N5O2 — CID 150401923

IUPAC4-[6-[3-(3-methoxyphenyl)pyrazol-1-yl]pyrimidin-4-yl]morpholine
SMILESCOc1cccc(-c2ccn(-c3cc(N4CCOCC4)ncn3)n2)c1
InChIInChI=1S/C18H19N5O2/c1-24-15-4-2-3-14(11-15)16-5-6-23(21-16)18-12-17(19-13-20-18)22-7-9-25-10-8-22/h2-6,11-13H,7-10H2,1H3
InChIKeyHDYGYCCTXYJULT-UHFFFAOYSA-N
MW337.38 g/mol
LogP2.17
Rot. Bonds4

About 4-[6-[3-(3-methoxyphenyl)pyrazol-1-yl]pyrimidin-4-yl]morpholine

4-[6-[3-(3-methoxyphenyl)pyrazol-1-yl]pyrimidin-4-yl]morpholine (PubChem CID 150401923) has the molecular formula C18H19N5O2 and a molecular weight of 337.38 g/mol. Its IUPAC name is 4-[6-[3-(3-methoxyphenyl)pyrazol-1-yl]pyrimidin-4-yl]morpholine.

Molecular Properties

Compound Name4-[6-[3-(3-methoxyphenyl)pyrazol-1-yl]pyrimidin-4-yl]morpholine
PubChem CID150401923
Molecular FormulaC18H19N5O2
Molecular Weight337.38 g/mol
Exact Mass337.15
IUPAC Name4-[6-[3-(3-methoxyphenyl)pyrazol-1-yl]pyrimidin-4-yl]morpholine
SMILESCOc1cccc(-c2ccn(-c3cc(N4CCOCC4)ncn3)n2)c1
InChIInChI=1S/C18H19N5O2/c1-24-15-4-2-3-14(11-15)16-5-6-23(21-16)18-12-17(19-13-20-18)22-7-9-25-10-8-22/h2-6,11-13H,7-10H2,1H3
InChIKeyHDYGYCCTXYJULT-UHFFFAOYSA-N
XLogP2.17
TPSA65.30 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 52.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

4-[2-(3-methoxyphenyl)imidazo[1,2-a]pyrimidin-7-yl]morpholine
CID 86342378
4-[2-(2-methoxyethyl)-6-[3-(3-methylphenyl)pyrazol-1-yl]pyrimidin-4-yl]morpholine
CID 156831967
2-[3-[5-[3-(3-methoxyphenyl)pyrazol-1-yl]-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-2-yl]-5-methylpyrazol-1-yl]-N,N-dimethylethanamine
CID 166165021
4-[2-[2-(3,4-dimethoxyphenyl)ethoxy]-6-[3-(3-methylphenyl)pyrazol-1-yl]pyrimidin-4-yl]morpholine
CID 156831887
4-[2-[2-(1-methylimidazol-4-yl)ethoxy]-6-[3-(3-methylphenyl)pyrazol-1-yl]pyrimidin-4-yl]morpholine
CID 156832043
4-(6-phenylpyrimidin-4-yl)morpholine
CID 1082059
4-[4-(3-methoxyphenyl)piperazin-1-yl]-6-pyrazol-1-ylpyrimidine
CID 154853650
4-[4-[(3aR,6aR)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]pyrrol-4-yl]-6-[3-(3-methoxyphenyl)pyrazol-1-yl]pyrimidin-2-yl]oxybutane-1,2-diol;4-[6-[3-(3-methoxyphenyl)pyrazol-1-yl]-2-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]pyrimidin-4-yl]morpholine;4-[4-[3-(3-methoxyphenyl)pyrazol-1-yl]-6-morpholin-4-ylpyrimidin-2-yl]oxybutane-1,2-diol
CID 158985512
4-[6-[3-(3-methylphenyl)pyrazol-1-yl]-2-[3-(triazol-2-yl)propyl]pyrimidin-4-yl]morpholine
CID 156832136
(3R)-4-[5-[3-(3-methoxyphenyl)pyrazol-1-yl]-2-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-7-yl]-3-methylmorpholine
CID 163266624
(2S)-4-[5-[3-(3-methoxyphenyl)pyrazol-1-yl]-2-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-7-yl]-2-methylmorpholine
CID 163266546
2-[4-[3-(3-methylphenyl)pyrazol-1-yl]-6-morpholin-4-ylpyrimidin-2-yl]propane-1,2-diol
CID 170269025

Frequently Asked Questions

What is the IUPAC name of 4-[6-[3-(3-methoxyphenyl)pyrazol-1-yl]pyrimidin-4-yl]morpholine?
The IUPAC name of 4-[6-[3-(3-methoxyphenyl)pyrazol-1-yl]pyrimidin-4-yl]morpholine (CID 150401923) is 4-[6-[3-(3-methoxyphenyl)pyrazol-1-yl]pyrimidin-4-yl]morpholine.
What is the SMILES notation for 4-[6-[3-(3-methoxyphenyl)pyrazol-1-yl]pyrimidin-4-yl]morpholine?
The canonical SMILES for 4-[6-[3-(3-methoxyphenyl)pyrazol-1-yl]pyrimidin-4-yl]morpholine is COc1cccc(-c2ccn(-c3cc(N4CCOCC4)ncn3)n2)c1.
What is the InChIKey of 4-[6-[3-(3-methoxyphenyl)pyrazol-1-yl]pyrimidin-4-yl]morpholine?
The InChIKey is HDYGYCCTXYJULT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N5O2/c1-24-15-4-2-3-14(11-15)16-5-6-23(21-16)18-12-17(19-13-20-18)22-7-9-25-10-8-22/h2-6,11-13H,7-10H2,1H3.
What are the key properties of 4-[6-[3-(3-methoxyphenyl)pyrazol-1-yl]pyrimidin-4-yl]morpholine?
4-[6-[3-(3-methoxyphenyl)pyrazol-1-yl]pyrimidin-4-yl]morpholine has a molecular weight of 337.38 g/mol, XLogP of 2.17, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[6-[3-(3-methoxyphenyl)pyrazol-1-yl]pyrimidin-4-yl]morpholine is sourced from PubChem (CID 150401923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).