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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Related Compounds

1-[3-[(2-oxo-3H-indol-1-yl)methyl]furan-2-carbonyl]pyrrolidine-3-carboxylic acid
CID 119354664
1-[[2-[(3S)-3-(aminomethyl)pyrrolidine-1-carbonyl]furan-3-yl]methyl]-3H-indol-2-one
CID 125146734
1-[[2-[3-(methylaminomethyl)piperidine-1-carbonyl]furan-3-yl]methyl]-3H-indol-2-one
CID 119395775
1-[[2-[3-(1-aminoethyl)piperidine-1-carbonyl]furan-3-yl]methyl]-3H-indol-2-one;hydrochloride
CID 119593691
1-[[2-[4-(cyclopropylmethylamino)piperidine-1-carbonyl]furan-3-yl]methyl]-3H-indol-2-one;hydrochloride
CID 119622525
N-(2-amino-1-cyclopropylethyl)-3-[(2-oxo-3H-indol-1-yl)methyl]furan-2-carboxamide
CID 119613936
3-[(2-oxo-3H-indol-1-yl)methyl]-N-piperidin-3-ylfuran-2-carboxamide;hydrochloride
CID 119425394
(2-bromophenyl)-[2-(hydroxymethyl)morpholin-4-yl]methanone
CID 81203060
furan-3-yl-[2-(hydroxymethyl)morpholin-4-yl]methanone
CID 81207986
(2,6-dichlorophenyl)-[2-(hydroxymethyl)morpholin-4-yl]methanone
CID 81207971
[3-(methylaminomethyl)pyrrolidin-1-yl]-[3-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-2-yl]methanone;dihydrochloride
CID 119540326
(2,3-dihydroxyphenyl)-[2-(hydroxymethyl)morpholin-4-yl]methanone
CID 114344564

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).