2-[4-[(1-phenylpyrazol-4-yl)methyl]morpholin-3-yl]cyclopentan-1-ol

C19H25N3O2 — CID 128982395

IUPAC2-[4-[(1-phenylpyrazol-4-yl)methyl]morpholin-3-yl]cyclopentan-1-ol
SMILESOC1CCCC1C1COCCN1Cc1cnn(-c2ccccc2)c1
InChIInChI=1S/C19H25N3O2/c23-19-8-4-7-17(19)18-14-24-10-9-21(18)12-15-11-20-22(13-15)16-5-2-1-3-6-16/h1-3,5-6,11,13,17-19,23H,4,7-10,12,14H2
InChIKeyGKNHMZBCCWMWCC-UHFFFAOYSA-N
MW327.43 g/mol
LogP2.23
Rot. Bonds4

About 2-[4-[(1-phenylpyrazol-4-yl)methyl]morpholin-3-yl]cyclopentan-1-ol

2-[4-[(1-phenylpyrazol-4-yl)methyl]morpholin-3-yl]cyclopentan-1-ol (PubChem CID 128982395) has the molecular formula C19H25N3O2 and a molecular weight of 327.43 g/mol. Its IUPAC name is 2-[4-[(1-phenylpyrazol-4-yl)methyl]morpholin-3-yl]cyclopentan-1-ol.

Molecular Properties

Compound Name2-[4-[(1-phenylpyrazol-4-yl)methyl]morpholin-3-yl]cyclopentan-1-ol
PubChem CID128982395
Molecular FormulaC19H25N3O2
Molecular Weight327.43 g/mol
Exact Mass327.19
IUPAC Name2-[4-[(1-phenylpyrazol-4-yl)methyl]morpholin-3-yl]cyclopentan-1-ol
SMILESOC1CCCC1C1COCCN1Cc1cnn(-c2ccccc2)c1
InChIInChI=1S/C19H25N3O2/c23-19-8-4-7-17(19)18-14-24-10-9-21(18)12-15-11-20-22(13-15)16-5-2-1-3-6-16/h1-3,5-6,11,13,17-19,23H,4,7-10,12,14H2
InChIKeyGKNHMZBCCWMWCC-UHFFFAOYSA-N
XLogP2.23
TPSA50.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.43
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[4-[(1-phenylpyrazol-4-yl)methyl]morpholin-3-yl]cyclopentan-1-ol?
The IUPAC name of 2-[4-[(1-phenylpyrazol-4-yl)methyl]morpholin-3-yl]cyclopentan-1-ol (CID 128982395) is 2-[4-[(1-phenylpyrazol-4-yl)methyl]morpholin-3-yl]cyclopentan-1-ol.
What is the SMILES notation for 2-[4-[(1-phenylpyrazol-4-yl)methyl]morpholin-3-yl]cyclopentan-1-ol?
The canonical SMILES for 2-[4-[(1-phenylpyrazol-4-yl)methyl]morpholin-3-yl]cyclopentan-1-ol is OC1CCCC1C1COCCN1Cc1cnn(-c2ccccc2)c1.
What is the InChIKey of 2-[4-[(1-phenylpyrazol-4-yl)methyl]morpholin-3-yl]cyclopentan-1-ol?
The InChIKey is GKNHMZBCCWMWCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O2/c23-19-8-4-7-17(19)18-14-24-10-9-21(18)12-15-11-20-22(13-15)16-5-2-1-3-6-16/h1-3,5-6,11,13,17-19,23H,4,7-10,12,14H2.
What are the key properties of 2-[4-[(1-phenylpyrazol-4-yl)methyl]morpholin-3-yl]cyclopentan-1-ol?
2-[4-[(1-phenylpyrazol-4-yl)methyl]morpholin-3-yl]cyclopentan-1-ol has a molecular weight of 327.43 g/mol, XLogP of 2.23, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(1-phenylpyrazol-4-yl)methyl]morpholin-3-yl]cyclopentan-1-ol is sourced from PubChem (CID 128982395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).