1-[[2-[2-(hydroxymethyl)morpholine-4-carbonyl]furan-3-yl]methyl]-3H-indol-2-one

C19H20N2O5 — CID 154858387

IUPAC1-[[2-[2-(hydroxymethyl)morpholine-4-carbonyl]furan-3-yl]methyl]-3H-indol-2-one
SMILESO=C(c1occc1CN1C(=O)Cc2ccccc21)N1CCOC(CO)C1
InChIInChI=1S/C19H20N2O5/c22-12-15-11-20(6-8-25-15)19(24)18-14(5-7-26-18)10-21-16-4-2-1-3-13(16)9-17(21)23/h1-5,7,15,22H,6,8-12H2
InChIKeyPAUUWEMFVLCVLM-UHFFFAOYSA-N
MW356.38 g/mol
LogP1.20
Rot. Bonds4

About 1-[[2-[2-(hydroxymethyl)morpholine-4-carbonyl]furan-3-yl]methyl]-3H-indol-2-one

1-[[2-[2-(hydroxymethyl)morpholine-4-carbonyl]furan-3-yl]methyl]-3H-indol-2-one (PubChem CID 154858387) has the molecular formula C19H20N2O5 and a molecular weight of 356.38 g/mol. Its IUPAC name is 1-[[2-[2-(hydroxymethyl)morpholine-4-carbonyl]furan-3-yl]methyl]-3H-indol-2-one.

Molecular Properties

Compound Name1-[[2-[2-(hydroxymethyl)morpholine-4-carbonyl]furan-3-yl]methyl]-3H-indol-2-one
PubChem CID154858387
Molecular FormulaC19H20N2O5
Molecular Weight356.38 g/mol
Exact Mass356.14
IUPAC Name1-[[2-[2-(hydroxymethyl)morpholine-4-carbonyl]furan-3-yl]methyl]-3H-indol-2-one
SMILESO=C(c1occc1CN1C(=O)Cc2ccccc21)N1CCOC(CO)C1
InChIInChI=1S/C19H20N2O5/c22-12-15-11-20(6-8-25-15)19(24)18-14(5-7-26-18)10-21-16-4-2-1-3-13(16)9-17(21)23/h1-5,7,15,22H,6,8-12H2
InChIKeyPAUUWEMFVLCVLM-UHFFFAOYSA-N
XLogP1.20
TPSA83.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.38
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-[[2-[2-(hydroxymethyl)morpholine-4-carbonyl]furan-3-yl]methyl]-3H-indol-2-one?
The IUPAC name of 1-[[2-[2-(hydroxymethyl)morpholine-4-carbonyl]furan-3-yl]methyl]-3H-indol-2-one (CID 154858387) is 1-[[2-[2-(hydroxymethyl)morpholine-4-carbonyl]furan-3-yl]methyl]-3H-indol-2-one.
What is the SMILES notation for 1-[[2-[2-(hydroxymethyl)morpholine-4-carbonyl]furan-3-yl]methyl]-3H-indol-2-one?
The canonical SMILES for 1-[[2-[2-(hydroxymethyl)morpholine-4-carbonyl]furan-3-yl]methyl]-3H-indol-2-one is O=C(c1occc1CN1C(=O)Cc2ccccc21)N1CCOC(CO)C1.
What is the InChIKey of 1-[[2-[2-(hydroxymethyl)morpholine-4-carbonyl]furan-3-yl]methyl]-3H-indol-2-one?
The InChIKey is PAUUWEMFVLCVLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O5/c22-12-15-11-20(6-8-25-15)19(24)18-14(5-7-26-18)10-21-16-4-2-1-3-13(16)9-17(21)23/h1-5,7,15,22H,6,8-12H2.
What are the key properties of 1-[[2-[2-(hydroxymethyl)morpholine-4-carbonyl]furan-3-yl]methyl]-3H-indol-2-one?
1-[[2-[2-(hydroxymethyl)morpholine-4-carbonyl]furan-3-yl]methyl]-3H-indol-2-one has a molecular weight of 356.38 g/mol, XLogP of 1.20, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[2-[2-(hydroxymethyl)morpholine-4-carbonyl]furan-3-yl]methyl]-3H-indol-2-one is sourced from PubChem (CID 154858387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).