[5-methyl-4-[(1-methylpyrazol-3-yl)methyl]morpholin-2-yl]methanol

C11H19N3O2 — CID 82877604

IUPAC[5-methyl-4-[(1-methylpyrazol-3-yl)methyl]morpholin-2-yl]methanol
SMILESCC1COC(CO)CN1Cc1ccn(C)n1
InChIInChI=1S/C11H19N3O2/c1-9-8-16-11(7-15)6-14(9)5-10-3-4-13(2)12-10/h3-4,9,11,15H,5-8H2,1-2H3
InChIKeyYATHCUPLGYHXSC-UHFFFAOYSA-N
MW225.29 g/mol
LogP0.00
Rot. Bonds3

About [5-methyl-4-[(1-methylpyrazol-3-yl)methyl]morpholin-2-yl]methanol

[5-methyl-4-[(1-methylpyrazol-3-yl)methyl]morpholin-2-yl]methanol (PubChem CID 82877604) has the molecular formula C11H19N3O2 and a molecular weight of 225.29 g/mol. Its IUPAC name is [5-methyl-4-[(1-methylpyrazol-3-yl)methyl]morpholin-2-yl]methanol.

Molecular Properties

Compound Name[5-methyl-4-[(1-methylpyrazol-3-yl)methyl]morpholin-2-yl]methanol
PubChem CID82877604
Molecular FormulaC11H19N3O2
Molecular Weight225.29 g/mol
Exact Mass225.15
IUPAC Name[5-methyl-4-[(1-methylpyrazol-3-yl)methyl]morpholin-2-yl]methanol
SMILESCC1COC(CO)CN1Cc1ccn(C)n1
InChIInChI=1S/C11H19N3O2/c1-9-8-16-11(7-15)6-14(9)5-10-3-4-13(2)12-10/h3-4,9,11,15H,5-8H2,1-2H3
InChIKeyYATHCUPLGYHXSC-UHFFFAOYSA-N
XLogP0.00
TPSA50.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 50.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(3S*,4S*)-1-[(5-methyl-1-propyl-1H-pyrazol-4-yl)methyl]-4-morpholin-4-ylpyrrolidin-3-ol
CID 77091611
4-{ethyl[(1-ethyl-1H-pyrazol-3-yl)methyl]amino}tetrahydrofuran-3-ol
CID 91833531
4-[(1-ethyl-1H-pyrazol-3-yl)methyl]-2-(2-methoxyethyl)morpholine
CID 91843740
4-[2-Fluoro-3-(3-methylpyrazol-1-yl)propyl]morpholine
CID 144666483
1-(diallylamino)-3-(3-methyl-1H-pyrazol-1-yl)propan-2-ol
CID 3397368
1-[[2-Hydroxy-3-[(2-methylpropan-2-yl)oxy]propyl]-propan-2-ylamino]-3-[3-(trifluoromethyl)pyrazol-1-yl]propan-2-ol
CID 3600313
1-[(3-Butoxy-2-hydroxypropyl)-propan-2-ylamino]-3-[3-(trifluoromethyl)pyrazol-1-yl]propan-2-ol
CID 3851254
1-Methoxy-3-[3-(trifluoromethyl)pyrazol-1-yl]propan-2-ol
CID 63929434
1-Ethoxy-3-[3-(trifluoromethyl)pyrazol-1-yl]propan-2-ol
CID 63932358
1-Propan-2-yloxy-3-[3-(trifluoromethyl)pyrazol-1-yl]propan-2-ol
CID 63987625
1-(Oxan-4-yloxy)-3-[3-(trifluoromethyl)pyrazol-1-yl]propan-2-ol
CID 75482627
1-[2-(Hydroxymethyl)morpholin-4-yl]-2-[3-(trifluoromethyl)pyrazol-1-yl]ethanone
CID 81208798

Frequently Asked Questions

What is the IUPAC name of [5-methyl-4-[(1-methylpyrazol-3-yl)methyl]morpholin-2-yl]methanol?
The IUPAC name of [5-methyl-4-[(1-methylpyrazol-3-yl)methyl]morpholin-2-yl]methanol (CID 82877604) is [5-methyl-4-[(1-methylpyrazol-3-yl)methyl]morpholin-2-yl]methanol.
What is the SMILES notation for [5-methyl-4-[(1-methylpyrazol-3-yl)methyl]morpholin-2-yl]methanol?
The canonical SMILES for [5-methyl-4-[(1-methylpyrazol-3-yl)methyl]morpholin-2-yl]methanol is CC1COC(CO)CN1Cc1ccn(C)n1.
What is the InChIKey of [5-methyl-4-[(1-methylpyrazol-3-yl)methyl]morpholin-2-yl]methanol?
The InChIKey is YATHCUPLGYHXSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O2/c1-9-8-16-11(7-15)6-14(9)5-10-3-4-13(2)12-10/h3-4,9,11,15H,5-8H2,1-2H3.
What are the key properties of [5-methyl-4-[(1-methylpyrazol-3-yl)methyl]morpholin-2-yl]methanol?
[5-methyl-4-[(1-methylpyrazol-3-yl)methyl]morpholin-2-yl]methanol has a molecular weight of 225.29 g/mol, XLogP of 0.00, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-methyl-4-[(1-methylpyrazol-3-yl)methyl]morpholin-2-yl]methanol is sourced from PubChem (CID 82877604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).