2-(furan-3-yl)-1-(1H-pyrazol-4-yl)ethanamine

C9H11N3O — CID 130573296

IUPAC2-(furan-3-yl)-1-(1H-pyrazol-4-yl)ethanamine
SMILESNC(Cc1ccoc1)c1cn[nH]c1
InChIInChI=1S/C9H11N3O/c10-9(8-4-11-12-5-8)3-7-1-2-13-6-7/h1-2,4-6,9H,3,10H2,(H,11,12)
InChIKeyGUFWQALSOCXGEE-UHFFFAOYSA-N
MW177.21 g/mol
LogP1.25
Rot. Bonds3

About 2-(furan-3-yl)-1-(1H-pyrazol-4-yl)ethanamine

2-(furan-3-yl)-1-(1H-pyrazol-4-yl)ethanamine (PubChem CID 130573296) has the molecular formula C9H11N3O and a molecular weight of 177.21 g/mol. Its IUPAC name is 2-(furan-3-yl)-1-(1H-pyrazol-4-yl)ethanamine.

Molecular Properties

Compound Name2-(furan-3-yl)-1-(1H-pyrazol-4-yl)ethanamine
PubChem CID130573296
Molecular FormulaC9H11N3O
Molecular Weight177.21 g/mol
Exact Mass177.09
IUPAC Name2-(furan-3-yl)-1-(1H-pyrazol-4-yl)ethanamine
SMILESNC(Cc1ccoc1)c1cn[nH]c1
InChIInChI=1S/C9H11N3O/c10-9(8-4-11-12-5-8)3-7-1-2-13-6-7/h1-2,4-6,9H,3,10H2,(H,11,12)
InChIKeyGUFWQALSOCXGEE-UHFFFAOYSA-N
XLogP1.25
TPSA67.84 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.21
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(3-Furyl)pyrazole
CID 53671153
3-(furan-2-yl)-4-methyl-1H-pyrazole
CID 2777107
5-(3-methylfuran-2-yl)-1H-pyrazole
CID 53631452
7-(Furan-3-yl)-1,5-dihydropyrazolo[4,5-d]pyridazin-4-one
CID 54766299
3-(furan-3-yl)-3-[4-(1H-pyrazol-4-yl)phenyl]propan-1-amine
CID 59446627
3-(furan-2-yl)-3-[4-(1H-pyrazol-4-yl)phenyl]propan-1-amine
CID 59446710
4-ethyl-5-(furan-2-yl)-1H-pyrazole
CID 68222954
3-[2-(Furan-3-yl)ethyl]pyrazol-1-amine
CID 69040708
furan-2-yl(1H-pyrazol-4-yl)methanamine
CID 69565565
7-(Furan-3-ylmethyl)-1,5-dihydropyrazolo[4,5-d]pyridazin-4-one
CID 70649020
4-(furan-3-yl)-1H-pyrazole
CID 126851921
ethane;5-(furan-2-yl)-4-methyl-1H-pyrazole
CID 144025915

Frequently Asked Questions

What is the IUPAC name of 2-(furan-3-yl)-1-(1H-pyrazol-4-yl)ethanamine?
The IUPAC name of 2-(furan-3-yl)-1-(1H-pyrazol-4-yl)ethanamine (CID 130573296) is 2-(furan-3-yl)-1-(1H-pyrazol-4-yl)ethanamine.
What is the SMILES notation for 2-(furan-3-yl)-1-(1H-pyrazol-4-yl)ethanamine?
The canonical SMILES for 2-(furan-3-yl)-1-(1H-pyrazol-4-yl)ethanamine is NC(Cc1ccoc1)c1cn[nH]c1.
What is the InChIKey of 2-(furan-3-yl)-1-(1H-pyrazol-4-yl)ethanamine?
The InChIKey is GUFWQALSOCXGEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O/c10-9(8-4-11-12-5-8)3-7-1-2-13-6-7/h1-2,4-6,9H,3,10H2,(H,11,12).
What are the key properties of 2-(furan-3-yl)-1-(1H-pyrazol-4-yl)ethanamine?
2-(furan-3-yl)-1-(1H-pyrazol-4-yl)ethanamine has a molecular weight of 177.21 g/mol, XLogP of 1.25, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-3-yl)-1-(1H-pyrazol-4-yl)ethanamine is sourced from PubChem (CID 130573296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).