3-[(4-methylpyrazol-1-yl)methyl]morpholine

C9H15N3O — CID 165375298

IUPAC3-[(4-methylpyrazol-1-yl)methyl]morpholine
SMILESCc1cnn(CC2COCCN2)c1
InChIInChI=1S/C9H15N3O/c1-8-4-11-12(5-8)6-9-7-13-3-2-10-9/h4-5,9-10H,2-3,6-7H2,1H3
InChIKeyIOZWUTROGWFDOT-UHFFFAOYSA-N
MW181.24 g/mol
LogP0.18
Rot. Bonds2

About 3-[(4-methylpyrazol-1-yl)methyl]morpholine

3-[(4-methylpyrazol-1-yl)methyl]morpholine (PubChem CID 165375298) has the molecular formula C9H15N3O and a molecular weight of 181.24 g/mol. Its IUPAC name is 3-[(4-methylpyrazol-1-yl)methyl]morpholine.

Molecular Properties

Compound Name3-[(4-methylpyrazol-1-yl)methyl]morpholine
PubChem CID165375298
Molecular FormulaC9H15N3O
Molecular Weight181.24 g/mol
Exact Mass181.12
IUPAC Name3-[(4-methylpyrazol-1-yl)methyl]morpholine
SMILESCc1cnn(CC2COCCN2)c1
InChIInChI=1S/C9H15N3O/c1-8-4-11-12(5-8)6-9-7-13-3-2-10-9/h4-5,9-10H,2-3,6-7H2,1H3
InChIKeyIOZWUTROGWFDOT-UHFFFAOYSA-N
XLogP0.18
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.24
LogP ≤ 50.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[(2,5-dimethylpyrrol-1-yl)methyl]morpholine
CID 103549624
1,4-dimethylpyrazole;ethane;4-propan-2-yl-1-(pyrrolidin-2-ylmethyl)pyrazole
CID 171834779
6-[(4-methylpyrazol-1-yl)methyl]-1,3-oxazinan-2-one
CID 123794786
3-[2-(1,3-dimethylpyrazol-4-yl)ethyl]morpholine
CID 104704094
4,7-dimethyl-2-(morpholin-3-ylmethyl)isoindole-1,3-dione
CID 103549560
3-[(5-methyl-3,6-dihydro-2H-pyridin-1-yl)methyl]morpholine
CID 106314919
3-[(5-methylfuran-2-yl)methyl]morpholine
CID 116927979
3-[(5-tert-butyl-1H-imidazol-2-yl)methyl]morpholine
CID 116881149
3-[2-methyl-4-(1-methylpyrazol-4-yl)but-2-enyl]morpholine
CID 103019540
3-[(4,5-dimethyl-1H-pyrazol-3-yl)methyl]morpholine
CID 83858621
1-methyl-4-[(4-methylpyrazol-1-yl)methyl]piperidine
CID 70661040
3-ethyl-1-[2-(4-methylpyrazol-1-yl)ethyl]-1,4-diazepane
CID 114279126

Frequently Asked Questions

What is the IUPAC name of 3-[(4-methylpyrazol-1-yl)methyl]morpholine?
The IUPAC name of 3-[(4-methylpyrazol-1-yl)methyl]morpholine (CID 165375298) is 3-[(4-methylpyrazol-1-yl)methyl]morpholine.
What is the SMILES notation for 3-[(4-methylpyrazol-1-yl)methyl]morpholine?
The canonical SMILES for 3-[(4-methylpyrazol-1-yl)methyl]morpholine is Cc1cnn(CC2COCCN2)c1.
What is the InChIKey of 3-[(4-methylpyrazol-1-yl)methyl]morpholine?
The InChIKey is IOZWUTROGWFDOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O/c1-8-4-11-12(5-8)6-9-7-13-3-2-10-9/h4-5,9-10H,2-3,6-7H2,1H3.
What are the key properties of 3-[(4-methylpyrazol-1-yl)methyl]morpholine?
3-[(4-methylpyrazol-1-yl)methyl]morpholine has a molecular weight of 181.24 g/mol, XLogP of 0.18, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-methylpyrazol-1-yl)methyl]morpholine is sourced from PubChem (CID 165375298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).