2-[2-methoxy-4-[[(2R)-2-[6-(1H-pyrazol-4-yl)-2-pyridinyl]morpholin-4-yl]methyl]phenoxy]acetamide

C22H25N5O4 — CID 124981115

IUPAC2-[2-methoxy-4-[[(2R)-2-[6-(1H-pyrazol-4-yl)-2-pyridinyl]morpholin-4-yl]methyl]phenoxy]acetamide
SMILESCOc1cc(CN2CCO[C@@H](c3cccc(-c4cn[nH]c4)n3)C2)ccc1OCC(N)=O
InChIInChI=1S/C22H25N5O4/c1-29-20-9-15(5-6-19(20)31-14-22(23)28)12-27-7-8-30-21(13-27)18-4-2-3-17(26-18)16-10-24-25-11-16/h2-6,9-11,21H,7-8,12-14H2,1H3,(H2,23,28)(H,24,25)/t21-/m1/s1
InChIKeyMNWQUKDIBXFRLK-OAQYLSRUSA-N
MW423.47 g/mol
LogP1.92
Rot. Bonds8

About 2-[2-methoxy-4-[[(2R)-2-[6-(1H-pyrazol-4-yl)-2-pyridinyl]morpholin-4-yl]methyl]phenoxy]acetamide

2-[2-methoxy-4-[[(2R)-2-[6-(1H-pyrazol-4-yl)-2-pyridinyl]morpholin-4-yl]methyl]phenoxy]acetamide (PubChem CID 124981115) has the molecular formula C22H25N5O4 and a molecular weight of 423.47 g/mol. Its IUPAC name is 2-[2-methoxy-4-[[(2R)-2-[6-(1H-pyrazol-4-yl)-2-pyridinyl]morpholin-4-yl]methyl]phenoxy]acetamide.

Molecular Properties

Compound Name2-[2-methoxy-4-[[(2R)-2-[6-(1H-pyrazol-4-yl)-2-pyridinyl]morpholin-4-yl]methyl]phenoxy]acetamide
PubChem CID124981115
Molecular FormulaC22H25N5O4
Molecular Weight423.47 g/mol
Exact Mass423.19
IUPAC Name2-[2-methoxy-4-[[(2R)-2-[6-(1H-pyrazol-4-yl)-2-pyridinyl]morpholin-4-yl]methyl]phenoxy]acetamide
SMILESCOc1cc(CN2CCO[C@@H](c3cccc(-c4cn[nH]c4)n3)C2)ccc1OCC(N)=O
InChIInChI=1S/C22H25N5O4/c1-29-20-9-15(5-6-19(20)31-14-22(23)28)12-27-7-8-30-21(13-27)18-4-2-3-17(26-18)16-10-24-25-11-16/h2-6,9-11,21H,7-8,12-14H2,1H3,(H2,23,28)(H,24,25)/t21-/m1/s1
InChIKeyMNWQUKDIBXFRLK-OAQYLSRUSA-N
XLogP1.92
TPSA115.59 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500423.47
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

2-[2-methoxy-4-[[(2S)-2-[6-(pyridin-2-ylamino)-2-pyridinyl]morpholin-4-yl]methyl]phenoxy]acetamide
CID 125013560
2-[2-methoxy-4-[(2-methyl-1,4-oxazepan-4-yl)methyl]phenoxy]acetamide
CID 77084796
2-[4-[[(4aS,8aR)-3-oxo-4,4a,5,7,8,8a-hexahydropyrido[4,3-b][1,4]oxazin-6-yl]methyl]-2-methoxyphenoxy]acetamide
CID 110135846
3-[6-[(2S)-4-[(4-methoxy-2,3,6-trimethylphenyl)methyl]morpholin-2-yl]-2-pyridinyl]benzamide
CID 124940397
3-[6-[4-[(4-methoxy-2,3,6-trimethylphenyl)methyl]morpholin-2-yl]-2-pyridinyl]benzamide
CID 127250616
4-[(6-methoxy-2H-chromen-3-yl)methyl]-2-[6-(1H-pyrazol-4-yl)-2-pyridinyl]morpholine
CID 132778350
4-[6-[(2R)-4-[(2-methoxy-4-methylphenyl)methyl]morpholin-2-yl]-2-pyridinyl]benzamide
CID 125025576
4-[6-[(2S)-4-[(4-fluorophenyl)methyl]morpholin-2-yl]-2-pyridinyl]benzamide
CID 124963234
2-[3-[[(2S)-2-(5-ethyl-1H-1,2,4-triazol-3-yl)morpholin-4-yl]methyl]phenoxy]acetamide
CID 96997026
3-[6-[(2R)-4-[[2-(dimethylamino)pyrimidin-5-yl]methyl]morpholin-2-yl]-2-pyridinyl]benzamide
CID 124956411
(2S)-2-[6-(4-methoxyphenyl)-2-pyridinyl]-4-(quinolin-6-ylmethyl)morpholine
CID 125021519
(2S)-2-[6-(4-methoxyphenyl)-2-pyridinyl]-4-[(1-methylpyrazol-4-yl)methyl]morpholine
CID 124975171

Frequently Asked Questions

What is the IUPAC name of 2-[2-methoxy-4-[[(2R)-2-[6-(1H-pyrazol-4-yl)-2-pyridinyl]morpholin-4-yl]methyl]phenoxy]acetamide?
The IUPAC name of 2-[2-methoxy-4-[[(2R)-2-[6-(1H-pyrazol-4-yl)-2-pyridinyl]morpholin-4-yl]methyl]phenoxy]acetamide (CID 124981115) is 2-[2-methoxy-4-[[(2R)-2-[6-(1H-pyrazol-4-yl)-2-pyridinyl]morpholin-4-yl]methyl]phenoxy]acetamide.
What is the SMILES notation for 2-[2-methoxy-4-[[(2R)-2-[6-(1H-pyrazol-4-yl)-2-pyridinyl]morpholin-4-yl]methyl]phenoxy]acetamide?
The canonical SMILES for 2-[2-methoxy-4-[[(2R)-2-[6-(1H-pyrazol-4-yl)-2-pyridinyl]morpholin-4-yl]methyl]phenoxy]acetamide is COc1cc(CN2CCO[C@@H](c3cccc(-c4cn[nH]c4)n3)C2)ccc1OCC(N)=O.
What is the InChIKey of 2-[2-methoxy-4-[[(2R)-2-[6-(1H-pyrazol-4-yl)-2-pyridinyl]morpholin-4-yl]methyl]phenoxy]acetamide?
The InChIKey is MNWQUKDIBXFRLK-OAQYLSRUSA-N. The full InChI is InChI=1S/C22H25N5O4/c1-29-20-9-15(5-6-19(20)31-14-22(23)28)12-27-7-8-30-21(13-27)18-4-2-3-17(26-18)16-10-24-25-11-16/h2-6,9-11,21H,7-8,12-14H2,1H3,(H2,23,28)(H,24,25)/t21-/m1/s1.
What are the key properties of 2-[2-methoxy-4-[[(2R)-2-[6-(1H-pyrazol-4-yl)-2-pyridinyl]morpholin-4-yl]methyl]phenoxy]acetamide?
2-[2-methoxy-4-[[(2R)-2-[6-(1H-pyrazol-4-yl)-2-pyridinyl]morpholin-4-yl]methyl]phenoxy]acetamide has a molecular weight of 423.47 g/mol, XLogP of 1.92, 8 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-methoxy-4-[[(2R)-2-[6-(1H-pyrazol-4-yl)-2-pyridinyl]morpholin-4-yl]methyl]phenoxy]acetamide is sourced from PubChem (CID 124981115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).