6-(1-ethylpyrazol-4-yl)oxy-3-(methylamino)-1,3-dihydroindol-2-one

C14H16N4O2 — CID 116801695

IUPAC6-(1-ethylpyrazol-4-yl)oxy-3-(methylamino)-1,3-dihydroindol-2-one
SMILESCCn1cc(Oc2ccc3c(c2)NC(=O)C3NC)cn1
InChIInChI=1S/C14H16N4O2/c1-3-18-8-10(7-16-18)20-9-4-5-11-12(6-9)17-14(19)13(11)15-2/h4-8,13,15H,3H2,1-2H3,(H,17,19)
InChIKeyLXBWODNFCQJSFT-UHFFFAOYSA-N
MW272.31 g/mol
LogP1.91
Rot. Bonds4

About 6-(1-ethylpyrazol-4-yl)oxy-3-(methylamino)-1,3-dihydroindol-2-one

6-(1-ethylpyrazol-4-yl)oxy-3-(methylamino)-1,3-dihydroindol-2-one (PubChem CID 116801695) has the molecular formula C14H16N4O2 and a molecular weight of 272.31 g/mol. Its IUPAC name is 6-(1-ethylpyrazol-4-yl)oxy-3-(methylamino)-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name6-(1-ethylpyrazol-4-yl)oxy-3-(methylamino)-1,3-dihydroindol-2-one
PubChem CID116801695
Molecular FormulaC14H16N4O2
Molecular Weight272.31 g/mol
Exact Mass272.13
IUPAC Name6-(1-ethylpyrazol-4-yl)oxy-3-(methylamino)-1,3-dihydroindol-2-one
SMILESCCn1cc(Oc2ccc3c(c2)NC(=O)C3NC)cn1
InChIInChI=1S/C14H16N4O2/c1-3-18-8-10(7-16-18)20-9-4-5-11-12(6-9)17-14(19)13(11)15-2/h4-8,13,15H,3H2,1-2H3,(H,17,19)
InChIKeyLXBWODNFCQJSFT-UHFFFAOYSA-N
XLogP1.91
TPSA68.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.31
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-(3-chlorophenoxy)-3-(methylamino)-1,3-dihydroindol-2-one
CID 63369681
3-(methylamino)-6-(2-methylsulfanylphenoxy)-1,3-dihydroindol-2-one
CID 63647488
4-(4-bromophenoxy)-1-ethylpyrazole
CID 117229573
4-(1-ethylpyrazol-4-yl)oxyaniline
CID 116800266
1-[4-(1-ethylpyrazol-4-yl)oxyphenyl]-N-methylethanamine
CID 116801665
3-amino-6-(4-ethylphenoxy)-1,3-dihydroindol-2-one
CID 63369720
4-(1-ethylpyrazol-4-yl)oxypyridin-2-amine
CID 116805835
N-[[4-(1-ethylpyrazol-4-yl)oxy-2-methylphenyl]methyl]-2-methylpropan-1-amine
CID 116802120
[4-(1-ethylpyrazol-4-yl)oxy-2-pyridinyl]hydrazine
CID 116806789
1-[5-(1-ethylpyrazol-4-yl)oxy-2-pyridinyl]-N-methylethanamine
CID 116801689
(1S)-1-[4-(1-ethylpyrazol-4-yl)oxyphenyl]propan-1-ol
CID 114066991
6-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(methylamino)-1,3-dihydroindol-2-one
CID 43586866

Frequently Asked Questions

What is the IUPAC name of 6-(1-ethylpyrazol-4-yl)oxy-3-(methylamino)-1,3-dihydroindol-2-one?
The IUPAC name of 6-(1-ethylpyrazol-4-yl)oxy-3-(methylamino)-1,3-dihydroindol-2-one (CID 116801695) is 6-(1-ethylpyrazol-4-yl)oxy-3-(methylamino)-1,3-dihydroindol-2-one.
What is the SMILES notation for 6-(1-ethylpyrazol-4-yl)oxy-3-(methylamino)-1,3-dihydroindol-2-one?
The canonical SMILES for 6-(1-ethylpyrazol-4-yl)oxy-3-(methylamino)-1,3-dihydroindol-2-one is CCn1cc(Oc2ccc3c(c2)NC(=O)C3NC)cn1.
What is the InChIKey of 6-(1-ethylpyrazol-4-yl)oxy-3-(methylamino)-1,3-dihydroindol-2-one?
The InChIKey is LXBWODNFCQJSFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O2/c1-3-18-8-10(7-16-18)20-9-4-5-11-12(6-9)17-14(19)13(11)15-2/h4-8,13,15H,3H2,1-2H3,(H,17,19).
What are the key properties of 6-(1-ethylpyrazol-4-yl)oxy-3-(methylamino)-1,3-dihydroindol-2-one?
6-(1-ethylpyrazol-4-yl)oxy-3-(methylamino)-1,3-dihydroindol-2-one has a molecular weight of 272.31 g/mol, XLogP of 1.91, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-ethylpyrazol-4-yl)oxy-3-(methylamino)-1,3-dihydroindol-2-one is sourced from PubChem (CID 116801695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).