(2R)-N-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methyl]-1-pyrazol-1-ylpropan-2-amine

C13H15N5O2 — CID 95158981

IUPAC(2R)-N-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methyl]-1-pyrazol-1-ylpropan-2-amine
SMILESC[C@H](Cn1cccn1)NCc1nc(-c2ccco2)no1
InChIInChI=1S/C13H15N5O2/c1-10(9-18-6-3-5-15-18)14-8-12-16-13(17-20-12)11-4-2-7-19-11/h2-7,10,14H,8-9H2,1H3/t10-/m1/s1
InChIKeyLUBLFSTXGLHMDF-SNVBAGLBSA-N
MW273.30 g/mol
LogP1.70
Rot. Bonds6

About (2R)-N-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methyl]-1-pyrazol-1-ylpropan-2-amine

(2R)-N-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methyl]-1-pyrazol-1-ylpropan-2-amine (PubChem CID 95158981) has the molecular formula C13H15N5O2 and a molecular weight of 273.30 g/mol. Its IUPAC name is (2R)-N-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methyl]-1-pyrazol-1-ylpropan-2-amine.

Molecular Properties

Compound Name(2R)-N-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methyl]-1-pyrazol-1-ylpropan-2-amine
PubChem CID95158981
Molecular FormulaC13H15N5O2
Molecular Weight273.30 g/mol
Exact Mass273.12
IUPAC Name(2R)-N-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methyl]-1-pyrazol-1-ylpropan-2-amine
SMILESC[C@H](Cn1cccn1)NCc1nc(-c2ccco2)no1
InChIInChI=1S/C13H15N5O2/c1-10(9-18-6-3-5-15-18)14-8-12-16-13(17-20-12)11-4-2-7-19-11/h2-7,10,14H,8-9H2,1H3/t10-/m1/s1
InChIKeyLUBLFSTXGLHMDF-SNVBAGLBSA-N
XLogP1.70
TPSA81.91 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.30
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze (2R)-N-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methyl]-1-pyrazol-1-ylpropan-2-amine with MolForge

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Related Compounds

2-(2-furyl)-6-(1H-pyrazol-1-yl)pyrimidin-4-amine
CID 11424684
N-(2-(furan-2-yl)-6-(1H-pyrazol-1-yl)pyrimidin-4-yl)-2-(4-methylpiperazin-1-yl)acetamide
CID 11956193
N-[2-(5-methylfuran-2-yl)-6-(1H-pyrazol-1-yl)pyrimidin-4-yl]-2-(4-methylpiperazin-1-yl)acetamide
CID 24768402
N-(2-furan-2-yl-6-pyrazol-1-yl-pyrimidin-4-yl)-acetamide
CID 11380183
N-(2-furan-2-yl-6-pyrazol-1-yl-pyrimidin-4-yl)-2-morpholin-4-yl-acetamide (21)
CID 11956192
2-dimethylamino-N-(2-furan-2-yl-6-pyrazol-1-yl-pyrimidin-4-yl)-acetamide
CID 24778159
N-(2-furylmethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
CID 821828
4-(Furan-2-yl)-11-methyl-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(12),2,4,9-tetraen-7-one
CID 136236319
US10118930, Example 110
CID 137018272
1-[5-(Furan-2-yl)-2-methyl-[1,2,4]triazolo[1,5-c]pyrimidin-7-yl]-3-(2-pyrrolidin-1-ylethyl)urea
CID 162467360
3-(furan-2-yl)-5-[[4-(1H-pyrazol-5-yl)piperidin-1-yl]methyl]-1,2,4-oxadiazole
CID 51104544
N-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methyl]-1-pyrazol-1-ylpropan-2-amine
CID 53551489

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methyl]-1-pyrazol-1-ylpropan-2-amine?
The IUPAC name of (2R)-N-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methyl]-1-pyrazol-1-ylpropan-2-amine (CID 95158981) is (2R)-N-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methyl]-1-pyrazol-1-ylpropan-2-amine.
What is the SMILES notation for (2R)-N-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methyl]-1-pyrazol-1-ylpropan-2-amine?
The canonical SMILES for (2R)-N-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methyl]-1-pyrazol-1-ylpropan-2-amine is C[C@H](Cn1cccn1)NCc1nc(-c2ccco2)no1.
What is the InChIKey of (2R)-N-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methyl]-1-pyrazol-1-ylpropan-2-amine?
The InChIKey is LUBLFSTXGLHMDF-SNVBAGLBSA-N. The full InChI is InChI=1S/C13H15N5O2/c1-10(9-18-6-3-5-15-18)14-8-12-16-13(17-20-12)11-4-2-7-19-11/h2-7,10,14H,8-9H2,1H3/t10-/m1/s1.
What are the key properties of (2R)-N-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methyl]-1-pyrazol-1-ylpropan-2-amine?
(2R)-N-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methyl]-1-pyrazol-1-ylpropan-2-amine has a molecular weight of 273.30 g/mol, XLogP of 1.70, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methyl]-1-pyrazol-1-ylpropan-2-amine is sourced from PubChem (CID 95158981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).