1-[5-[(2-methyloxolan-3-yl)amino]-2,3-dihydroindol-1-yl]ethanone

C15H20N2O2 — CID 82727443

IUPAC1-[5-[(2-methyloxolan-3-yl)amino]-2,3-dihydroindol-1-yl]ethanone
SMILESCC(=O)N1CCc2cc(NC3CCOC3C)ccc21
InChIInChI=1S/C15H20N2O2/c1-10-14(6-8-19-10)16-13-3-4-15-12(9-13)5-7-17(15)11(2)18/h3-4,9-10,14,16H,5-8H2,1-2H3
InChIKeyCUNGSAOUCIHELD-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.18
Rot. Bonds2

About 1-[5-[(2-methyloxolan-3-yl)amino]-2,3-dihydroindol-1-yl]ethanone

1-[5-[(2-methyloxolan-3-yl)amino]-2,3-dihydroindol-1-yl]ethanone (PubChem CID 82727443) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 1-[5-[(2-methyloxolan-3-yl)amino]-2,3-dihydroindol-1-yl]ethanone.

Molecular Properties

Compound Name1-[5-[(2-methyloxolan-3-yl)amino]-2,3-dihydroindol-1-yl]ethanone
PubChem CID82727443
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name1-[5-[(2-methyloxolan-3-yl)amino]-2,3-dihydroindol-1-yl]ethanone
SMILESCC(=O)N1CCc2cc(NC3CCOC3C)ccc21
InChIInChI=1S/C15H20N2O2/c1-10-14(6-8-19-10)16-13-3-4-15-12(9-13)5-7-17(15)11(2)18/h3-4,9-10,14,16H,5-8H2,1-2H3
InChIKeyCUNGSAOUCIHELD-UHFFFAOYSA-N
XLogP2.18
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[5-(cyclopentylamino)-2,3-dihydroindol-1-yl]ethanone
CID 43684604
1-[4-[(1-acetyl-2,3-dihydroindol-5-yl)amino]piperidin-1-yl]ethanone
CID 4547632
1-[5-[(1,1-dioxothian-3-yl)amino]-2,3-dihydroindol-1-yl]ethanone
CID 63911652
1-[5-(oxolan-3-ylmethylamino)-2,3-dihydroindol-1-yl]ethanone
CID 43684646
1-[5-(2,3-dimethylmorpholin-4-yl)sulfonyl-2,3-dihydroindol-1-yl]ethanone
CID 110727870
N-(1-acetyl-2,3-dihydroindol-5-yl)-2,3-dihydro-1,4-dioxine-5-carboxamide
CID 39952143
N-(1-acetyl-2,3-dihydroindol-5-yl)-2-(oxolan-2-ylmethylamino)acetamide;hydrochloride
CID 119690413
methane;1-(5-methyl-2,3-dihydroindol-1-yl)ethanone
CID 159834618
1-(1-acetyl-2,3-dihydroindol-5-yl)-3-(4-methylphenyl)urea
CID 17485020
N-(1-acetyl-2,3-dihydroindol-5-yl)-2-bromoacetamide
CID 63679851
2-[(1-acetyl-2,3-dihydroindol-5-yl)amino]butanoic acid
CID 115352545
N-(1-acetyl-2,3-dihydroindol-5-yl)-2-(cyclopropylmethylamino)acetamide;hydrochloride
CID 119690426

Frequently Asked Questions

What is the IUPAC name of 1-[5-[(2-methyloxolan-3-yl)amino]-2,3-dihydroindol-1-yl]ethanone?
The IUPAC name of 1-[5-[(2-methyloxolan-3-yl)amino]-2,3-dihydroindol-1-yl]ethanone (CID 82727443) is 1-[5-[(2-methyloxolan-3-yl)amino]-2,3-dihydroindol-1-yl]ethanone.
What is the SMILES notation for 1-[5-[(2-methyloxolan-3-yl)amino]-2,3-dihydroindol-1-yl]ethanone?
The canonical SMILES for 1-[5-[(2-methyloxolan-3-yl)amino]-2,3-dihydroindol-1-yl]ethanone is CC(=O)N1CCc2cc(NC3CCOC3C)ccc21.
What is the InChIKey of 1-[5-[(2-methyloxolan-3-yl)amino]-2,3-dihydroindol-1-yl]ethanone?
The InChIKey is CUNGSAOUCIHELD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-10-14(6-8-19-10)16-13-3-4-15-12(9-13)5-7-17(15)11(2)18/h3-4,9-10,14,16H,5-8H2,1-2H3.
What are the key properties of 1-[5-[(2-methyloxolan-3-yl)amino]-2,3-dihydroindol-1-yl]ethanone?
1-[5-[(2-methyloxolan-3-yl)amino]-2,3-dihydroindol-1-yl]ethanone has a molecular weight of 260.34 g/mol, XLogP of 2.18, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-[(2-methyloxolan-3-yl)amino]-2,3-dihydroindol-1-yl]ethanone is sourced from PubChem (CID 82727443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).