3-[[(2-ethylpyrazol-3-yl)methylamino]methyl]oxolan-3-ol

C11H19N3O2 — CID 115765922

IUPAC3-[[(2-ethylpyrazol-3-yl)methylamino]methyl]oxolan-3-ol
SMILESCCn1nccc1CNCC1(O)CCOC1
InChIInChI=1S/C11H19N3O2/c1-2-14-10(3-5-13-14)7-12-8-11(15)4-6-16-9-11/h3,5,12,15H,2,4,6-9H2,1H3
InChIKeyCEUZARFRHGSUJF-UHFFFAOYSA-N
MW225.29 g/mol
LogP0.14
Rot. Bonds5

About 3-[[(2-ethylpyrazol-3-yl)methylamino]methyl]oxolan-3-ol

3-[[(2-ethylpyrazol-3-yl)methylamino]methyl]oxolan-3-ol (PubChem CID 115765922) has the molecular formula C11H19N3O2 and a molecular weight of 225.29 g/mol. Its IUPAC name is 3-[[(2-ethylpyrazol-3-yl)methylamino]methyl]oxolan-3-ol.

Molecular Properties

Compound Name3-[[(2-ethylpyrazol-3-yl)methylamino]methyl]oxolan-3-ol
PubChem CID115765922
Molecular FormulaC11H19N3O2
Molecular Weight225.29 g/mol
Exact Mass225.15
IUPAC Name3-[[(2-ethylpyrazol-3-yl)methylamino]methyl]oxolan-3-ol
SMILESCCn1nccc1CNCC1(O)CCOC1
InChIInChI=1S/C11H19N3O2/c1-2-14-10(3-5-13-14)7-12-8-11(15)4-6-16-9-11/h3,5,12,15H,2,4,6-9H2,1H3
InChIKeyCEUZARFRHGSUJF-UHFFFAOYSA-N
XLogP0.14
TPSA59.31 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 50.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-[[(3-ethylimidazol-4-yl)methylamino]methyl]oxolan-3-ol
CID 106099901
3-[[(1-ethylimidazol-2-yl)methylamino]methyl]oxolan-3-ol
CID 103848413
1-(2-ethylpyrazol-3-yl)-N-[(1-methylsulfanylcyclopropyl)methyl]methanamine
CID 107267292
3-[[(3-methylimidazol-4-yl)methylamino]methyl]oxolan-3-ol
CID 103848451
3-[[(4-trimethylsilylphenyl)methylamino]methyl]oxolan-3-ol
CID 106100480
1-cyclopropyl-N-[(2-ethylpyrazol-3-yl)methyl]methanamine
CID 115761680
3-[[(3-chloro-4-pyridinyl)methylamino]methyl]oxolan-3-ol
CID 106100683
4-ethyl-1-[[(2-propylpyrazol-3-yl)methylamino]methyl]cyclohexan-1-ol
CID 114555851
3-[[(1-propylpyrazol-4-yl)methylamino]methyl]oxolan-3-ol
CID 103848292
3-[[(1-ethyl-2,5-dimethylpyrrol-3-yl)methylamino]methyl]oxolan-3-ol
CID 106100066
3-[[(6-methyl-3-pyridinyl)methylamino]methyl]oxolan-3-ol
CID 104756694
3-methyl-1-[[(2-propylpyrazol-3-yl)methylamino]methyl]cyclohexan-1-ol
CID 114555849

Frequently Asked Questions

What is the IUPAC name of 3-[[(2-ethylpyrazol-3-yl)methylamino]methyl]oxolan-3-ol?
The IUPAC name of 3-[[(2-ethylpyrazol-3-yl)methylamino]methyl]oxolan-3-ol (CID 115765922) is 3-[[(2-ethylpyrazol-3-yl)methylamino]methyl]oxolan-3-ol.
What is the SMILES notation for 3-[[(2-ethylpyrazol-3-yl)methylamino]methyl]oxolan-3-ol?
The canonical SMILES for 3-[[(2-ethylpyrazol-3-yl)methylamino]methyl]oxolan-3-ol is CCn1nccc1CNCC1(O)CCOC1.
What is the InChIKey of 3-[[(2-ethylpyrazol-3-yl)methylamino]methyl]oxolan-3-ol?
The InChIKey is CEUZARFRHGSUJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O2/c1-2-14-10(3-5-13-14)7-12-8-11(15)4-6-16-9-11/h3,5,12,15H,2,4,6-9H2,1H3.
What are the key properties of 3-[[(2-ethylpyrazol-3-yl)methylamino]methyl]oxolan-3-ol?
3-[[(2-ethylpyrazol-3-yl)methylamino]methyl]oxolan-3-ol has a molecular weight of 225.29 g/mol, XLogP of 0.14, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[(2-ethylpyrazol-3-yl)methylamino]methyl]oxolan-3-ol is sourced from PubChem (CID 115765922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).