1-[2-(oxolan-2-yl)ethyl]pyrazol-3-amine

C9H15N3O — CID 65161520

IUPAC1-[2-(oxolan-2-yl)ethyl]pyrazol-3-amine
SMILESNc1ccn(CCC2CCCO2)n1
InChIInChI=1S/C9H15N3O/c10-9-4-6-12(11-9)5-3-8-2-1-7-13-8/h4,6,8H,1-3,5,7H2,(H2,10,11)
InChIKeyJIDUOUREGJTJLG-UHFFFAOYSA-N
MW181.24 g/mol
LogP1.03
Rot. Bonds3

About 1-[2-(oxolan-2-yl)ethyl]pyrazol-3-amine

1-[2-(oxolan-2-yl)ethyl]pyrazol-3-amine (PubChem CID 65161520) has the molecular formula C9H15N3O and a molecular weight of 181.24 g/mol. Its IUPAC name is 1-[2-(oxolan-2-yl)ethyl]pyrazol-3-amine.

Molecular Properties

Compound Name1-[2-(oxolan-2-yl)ethyl]pyrazol-3-amine
PubChem CID65161520
Molecular FormulaC9H15N3O
Molecular Weight181.24 g/mol
Exact Mass181.12
IUPAC Name1-[2-(oxolan-2-yl)ethyl]pyrazol-3-amine
SMILESNc1ccn(CCC2CCCO2)n1
InChIInChI=1S/C9H15N3O/c10-9-4-6-12(11-9)5-3-8-2-1-7-13-8/h4,6,8H,1-3,5,7H2,(H2,10,11)
InChIKeyJIDUOUREGJTJLG-UHFFFAOYSA-N
XLogP1.03
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.24
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[1-[3-(oxolan-2-yl)propyl]piperidin-4-yl]pyrazol-3-amine
CID 107109665
1-[2-(oxolan-2-yl)ethyl]-1,2,4-triazole
CID 65165120
1-[3-(oxolan-2-yl)propyl]pyrazole-3-carboxylic acid
CID 65162534
[3-methyl-1-[2-(oxolan-2-yl)ethyl]pyrazol-4-yl]methanamine
CID 65165798
N-[[1-[3-(oxolan-2-yl)propyl]pyrazol-3-yl]methyl]cyclopropanamine
CID 65165245
1-[2-(3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazin-4-yl)ethyl]pyrazol-3-amine
CID 63316357
4-methyl-1-[3-(oxolan-2-yl)propyl]pyrazol-3-amine
CID 65161363
1-[2-(oxolan-2-yl)ethyl]-4-phenylpyrazole
CID 119034768
N-methyl-1-[3-methyl-1-[2-(oxolan-2-yl)ethyl]pyrazol-4-yl]methanamine
CID 65165187
[1-[2-(oxolan-2-yl)ethyl]triazol-4-yl]methanol
CID 65166429
3-[2-(3-aminopyrazol-1-yl)ethyl]pyrrolidin-2-one
CID 130878221
4-(chloromethyl)-1-[2-(oxolan-2-yl)ethyl]pyrazole
CID 65165440

Frequently Asked Questions

What is the IUPAC name of 1-[2-(oxolan-2-yl)ethyl]pyrazol-3-amine?
The IUPAC name of 1-[2-(oxolan-2-yl)ethyl]pyrazol-3-amine (CID 65161520) is 1-[2-(oxolan-2-yl)ethyl]pyrazol-3-amine.
What is the SMILES notation for 1-[2-(oxolan-2-yl)ethyl]pyrazol-3-amine?
The canonical SMILES for 1-[2-(oxolan-2-yl)ethyl]pyrazol-3-amine is Nc1ccn(CCC2CCCO2)n1.
What is the InChIKey of 1-[2-(oxolan-2-yl)ethyl]pyrazol-3-amine?
The InChIKey is JIDUOUREGJTJLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O/c10-9-4-6-12(11-9)5-3-8-2-1-7-13-8/h4,6,8H,1-3,5,7H2,(H2,10,11).
What are the key properties of 1-[2-(oxolan-2-yl)ethyl]pyrazol-3-amine?
1-[2-(oxolan-2-yl)ethyl]pyrazol-3-amine has a molecular weight of 181.24 g/mol, XLogP of 1.03, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(oxolan-2-yl)ethyl]pyrazol-3-amine is sourced from PubChem (CID 65161520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).