2-(1-ethylpyrazol-4-yl)oxolan-3-amine

C9H15N3O — CID 103848592

IUPAC2-(1-ethylpyrazol-4-yl)oxolan-3-amine
SMILESCCn1cc(C2OCCC2N)cn1
InChIInChI=1S/C9H15N3O/c1-2-12-6-7(5-11-12)9-8(10)3-4-13-9/h5-6,8-9H,2-4,10H2,1H3
InChIKeyUINZMOADFXRHMR-UHFFFAOYSA-N
MW181.24 g/mol
LogP0.69
Rot. Bonds2

About 2-(1-ethylpyrazol-4-yl)oxolan-3-amine

2-(1-ethylpyrazol-4-yl)oxolan-3-amine (PubChem CID 103848592) has the molecular formula C9H15N3O and a molecular weight of 181.24 g/mol. Its IUPAC name is 2-(1-ethylpyrazol-4-yl)oxolan-3-amine.

Molecular Properties

Compound Name2-(1-ethylpyrazol-4-yl)oxolan-3-amine
PubChem CID103848592
Molecular FormulaC9H15N3O
Molecular Weight181.24 g/mol
Exact Mass181.12
IUPAC Name2-(1-ethylpyrazol-4-yl)oxolan-3-amine
SMILESCCn1cc(C2OCCC2N)cn1
InChIInChI=1S/C9H15N3O/c1-2-12-6-7(5-11-12)9-8(10)3-4-13-9/h5-6,8-9H,2-4,10H2,1H3
InChIKeyUINZMOADFXRHMR-UHFFFAOYSA-N
XLogP0.69
TPSA53.07 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 ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[(2R,3S)-2-(1-ethylpyrazol-4-yl)oxolan-3-yl]methanamine
CID 96835165
[(2R,3S)-2-(1-ethylpyrazol-4-yl)oxan-3-yl]methanamine
CID 122164121
(2R,3S)-2-(1-methylpyrazol-4-yl)oxolan-3-amine;dihydrochloride
CID 86775431
(2S,3R)-2-(1-ethylpyrazol-4-yl)oxolane-3-carboxylic acid
CID 124681119
(2S,3R)-2-(1-propan-2-ylpyrazol-4-yl)oxolan-3-amine;dihydrochloride
CID 122155807
N-[[2-(1-ethylpyrazol-4-yl)oxolan-3-yl]methyl]-2-methylpropan-1-amine
CID 113344558
N-[[2-(1-ethylpyrazol-4-yl)oxolan-3-yl]methyl]oxan-4-amine
CID 71873016
N-[(1-ethylpyrazol-4-yl)methyl]-1-[(2S,3R)-2-(1-methylpyrazol-4-yl)oxolan-3-yl]methanamine
CID 97060263
N-[(1-ethylpyrazol-4-yl)methyl]-1-[2-(1-methylpyrazol-4-yl)oxolan-3-yl]methanamine
CID 71929279
2-[[(2R,3S)-2-(1-ethylpyrazol-4-yl)oxolan-3-yl]methyl]-1-propan-2-ylguanidine
CID 122099176
N-[[2-(1-ethylpyrazol-4-yl)oxan-3-yl]methyl]-2-methylpropan-2-amine
CID 103571051
1-[(2S,3S)-2-(1-ethylpyrazol-4-yl)oxolan-3-yl]-N-[(5-methylfuran-2-yl)methyl]methanamine
CID 96997495

Frequently Asked Questions

What is the IUPAC name of 2-(1-ethylpyrazol-4-yl)oxolan-3-amine?
The IUPAC name of 2-(1-ethylpyrazol-4-yl)oxolan-3-amine (CID 103848592) is 2-(1-ethylpyrazol-4-yl)oxolan-3-amine.
What is the SMILES notation for 2-(1-ethylpyrazol-4-yl)oxolan-3-amine?
The canonical SMILES for 2-(1-ethylpyrazol-4-yl)oxolan-3-amine is CCn1cc(C2OCCC2N)cn1.
What is the InChIKey of 2-(1-ethylpyrazol-4-yl)oxolan-3-amine?
The InChIKey is UINZMOADFXRHMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O/c1-2-12-6-7(5-11-12)9-8(10)3-4-13-9/h5-6,8-9H,2-4,10H2,1H3.
What are the key properties of 2-(1-ethylpyrazol-4-yl)oxolan-3-amine?
2-(1-ethylpyrazol-4-yl)oxolan-3-amine has a molecular weight of 181.24 g/mol, XLogP of 0.69, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethylpyrazol-4-yl)oxolan-3-amine is sourced from PubChem (CID 103848592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).