5-(1-methylpyrazol-4-yl)spiro[1,3-dihydroindene-2,4'-5H-1,3-oxazole]-2'-amine

C15H16N4O — CID 58467257

IUPAC5-(1-methylpyrazol-4-yl)spiro[1,3-dihydroindene-2,4'-5H-1,3-oxazole]-2'-amine
SMILESCn1cc(-c2ccc3c(c2)CC2(COC(N)=N2)C3)cn1
InChIInChI=1S/C15H16N4O/c1-19-8-13(7-17-19)10-2-3-11-5-15(6-12(11)4-10)9-20-14(16)18-15/h2-4,7-8H,5-6,9H2,1H3,(H2,16,18)
InChIKeyUUBFFLWRJHKZQO-UHFFFAOYSA-N
MW268.32 g/mol
LogP1.27
Rot. Bonds1

About 5-(1-methylpyrazol-4-yl)spiro[1,3-dihydroindene-2,4'-5H-1,3-oxazole]-2'-amine

5-(1-methylpyrazol-4-yl)spiro[1,3-dihydroindene-2,4'-5H-1,3-oxazole]-2'-amine (PubChem CID 58467257) has the molecular formula C15H16N4O and a molecular weight of 268.32 g/mol. Its IUPAC name is 5-(1-methylpyrazol-4-yl)spiro[1,3-dihydroindene-2,4'-5H-1,3-oxazole]-2'-amine.

Molecular Properties

Compound Name5-(1-methylpyrazol-4-yl)spiro[1,3-dihydroindene-2,4'-5H-1,3-oxazole]-2'-amine
PubChem CID58467257
Molecular FormulaC15H16N4O
Molecular Weight268.32 g/mol
Exact Mass268.13
IUPAC Name5-(1-methylpyrazol-4-yl)spiro[1,3-dihydroindene-2,4'-5H-1,3-oxazole]-2'-amine
SMILESCn1cc(-c2ccc3c(c2)CC2(COC(N)=N2)C3)cn1
InChIInChI=1S/C15H16N4O/c1-19-8-13(7-17-19)10-2-3-11-5-15(6-12(11)4-10)9-20-14(16)18-15/h2-4,7-8H,5-6,9H2,1H3,(H2,16,18)
InChIKeyUUBFFLWRJHKZQO-UHFFFAOYSA-N
XLogP1.27
TPSA65.43 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[(1R,3S)-1-amino-3-[(6S)-6-[2-(1-methylpyrazol-4-yl)ethyl]-5,6,7,8-tetrahydronaphthalen-2-yl]cyclopentyl]methanol
CID 124142424
7-(1-methylpyrazol-4-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole]-2'-amine
CID 58466613
2'-methyl-5-(2-methylpyrazol-3-yl)spiro[1,3-dihydroindene-2,4'-5H-1,3-oxazole]
CID 58466629
(2R,5'R)-5'-methyl-4-(1H-pyrazol-4-yl)spiro[1,3-dihydroindene-2,4'-5H-1,3-oxazole]-2'-amine
CID 58466740
5-(1H-pyrazol-4-yl)spiro[1,3-dihydroindene-2,4'-5H-1,3-oxazole]-2'-amine
CID 58466757
(3R)-8-(2-methylpyrazol-3-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole]-2'-amine
CID 58466789
6-(2-methylpyrazol-3-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole]-2'-amine
CID 58466833
(2R,5'R)-5'-methyl-4-(1-methylpyrazol-4-yl)spiro[1,3-dihydroindene-2,4'-5H-1,3-oxazole]-2'-amine
CID 58467006
5-(1-propylpyrazol-4-yl)spiro[1,3-dihydroindene-2,4'-5H-1,3-oxazole]-2'-amine
CID 58467096
4-(1H-pyrazol-4-yl)spiro[1,3-dihydroindene-2,4'-5H-1,3-oxazole]-2'-amine
CID 58467104
5-(2-methylpyrazol-3-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole]-2'-amine
CID 58467156
4-(2-methylpyrazol-3-yl)spiro[1,3-dihydroindene-2,4'-5H-1,3-oxazole]-2'-amine
CID 58467226

Frequently Asked Questions

What is the IUPAC name of 5-(1-methylpyrazol-4-yl)spiro[1,3-dihydroindene-2,4'-5H-1,3-oxazole]-2'-amine?
The IUPAC name of 5-(1-methylpyrazol-4-yl)spiro[1,3-dihydroindene-2,4'-5H-1,3-oxazole]-2'-amine (CID 58467257) is 5-(1-methylpyrazol-4-yl)spiro[1,3-dihydroindene-2,4'-5H-1,3-oxazole]-2'-amine.
What is the SMILES notation for 5-(1-methylpyrazol-4-yl)spiro[1,3-dihydroindene-2,4'-5H-1,3-oxazole]-2'-amine?
The canonical SMILES for 5-(1-methylpyrazol-4-yl)spiro[1,3-dihydroindene-2,4'-5H-1,3-oxazole]-2'-amine is Cn1cc(-c2ccc3c(c2)CC2(COC(N)=N2)C3)cn1.
What is the InChIKey of 5-(1-methylpyrazol-4-yl)spiro[1,3-dihydroindene-2,4'-5H-1,3-oxazole]-2'-amine?
The InChIKey is UUBFFLWRJHKZQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O/c1-19-8-13(7-17-19)10-2-3-11-5-15(6-12(11)4-10)9-20-14(16)18-15/h2-4,7-8H,5-6,9H2,1H3,(H2,16,18).
What are the key properties of 5-(1-methylpyrazol-4-yl)spiro[1,3-dihydroindene-2,4'-5H-1,3-oxazole]-2'-amine?
5-(1-methylpyrazol-4-yl)spiro[1,3-dihydroindene-2,4'-5H-1,3-oxazole]-2'-amine has a molecular weight of 268.32 g/mol, XLogP of 1.27, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-methylpyrazol-4-yl)spiro[1,3-dihydroindene-2,4'-5H-1,3-oxazole]-2'-amine is sourced from PubChem (CID 58467257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).