[4-[(2-ethyl-5-methylpyrazol-3-yl)methyl]morpholin-2-yl]methanol

C12H21N3O2 — CID 81219626

IUPAC[4-[(2-ethyl-5-methylpyrazol-3-yl)methyl]morpholin-2-yl]methanol
SMILESCCn1nc(C)cc1CN1CCOC(CO)C1
InChIInChI=1S/C12H21N3O2/c1-3-15-11(6-10(2)13-15)7-14-4-5-17-12(8-14)9-16/h6,12,16H,3-5,7-9H2,1-2H3
InChIKeyWMLOPKLPAFBJGO-UHFFFAOYSA-N
MW239.32 g/mol
LogP0.40
Rot. Bonds4

About [4-[(2-ethyl-5-methylpyrazol-3-yl)methyl]morpholin-2-yl]methanol

[4-[(2-ethyl-5-methylpyrazol-3-yl)methyl]morpholin-2-yl]methanol (PubChem CID 81219626) has the molecular formula C12H21N3O2 and a molecular weight of 239.32 g/mol. Its IUPAC name is [4-[(2-ethyl-5-methylpyrazol-3-yl)methyl]morpholin-2-yl]methanol.

Molecular Properties

Compound Name[4-[(2-ethyl-5-methylpyrazol-3-yl)methyl]morpholin-2-yl]methanol
PubChem CID81219626
Molecular FormulaC12H21N3O2
Molecular Weight239.32 g/mol
Exact Mass239.16
IUPAC Name[4-[(2-ethyl-5-methylpyrazol-3-yl)methyl]morpholin-2-yl]methanol
SMILESCCn1nc(C)cc1CN1CCOC(CO)C1
InChIInChI=1S/C12H21N3O2/c1-3-15-11(6-10(2)13-15)7-14-4-5-17-12(8-14)9-16/h6,12,16H,3-5,7-9H2,1-2H3
InChIKeyWMLOPKLPAFBJGO-UHFFFAOYSA-N
XLogP0.40
TPSA50.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 50.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

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CID 25248518
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[4-[(2-hydrazinyl-4-pyridinyl)methyl]morpholin-2-yl]methanol
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CID 114482010
[4-[(5-hydrazinylpyrazin-2-yl)methyl]morpholin-2-yl]methanol
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Frequently Asked Questions

What is the IUPAC name of [4-[(2-ethyl-5-methylpyrazol-3-yl)methyl]morpholin-2-yl]methanol?
The IUPAC name of [4-[(2-ethyl-5-methylpyrazol-3-yl)methyl]morpholin-2-yl]methanol (CID 81219626) is [4-[(2-ethyl-5-methylpyrazol-3-yl)methyl]morpholin-2-yl]methanol.
What is the SMILES notation for [4-[(2-ethyl-5-methylpyrazol-3-yl)methyl]morpholin-2-yl]methanol?
The canonical SMILES for [4-[(2-ethyl-5-methylpyrazol-3-yl)methyl]morpholin-2-yl]methanol is CCn1nc(C)cc1CN1CCOC(CO)C1.
What is the InChIKey of [4-[(2-ethyl-5-methylpyrazol-3-yl)methyl]morpholin-2-yl]methanol?
The InChIKey is WMLOPKLPAFBJGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O2/c1-3-15-11(6-10(2)13-15)7-14-4-5-17-12(8-14)9-16/h6,12,16H,3-5,7-9H2,1-2H3.
What are the key properties of [4-[(2-ethyl-5-methylpyrazol-3-yl)methyl]morpholin-2-yl]methanol?
[4-[(2-ethyl-5-methylpyrazol-3-yl)methyl]morpholin-2-yl]methanol has a molecular weight of 239.32 g/mol, XLogP of 0.40, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(2-ethyl-5-methylpyrazol-3-yl)methyl]morpholin-2-yl]methanol is sourced from PubChem (CID 81219626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).