N-(2-hydroxy-2-methyl-3-morpholin-4-ylpropyl)-3-phenylfuran-2-carboxamide

C19H24N2O4 — CID 111698273

IUPACN-(2-hydroxy-2-methyl-3-morpholin-4-ylpropyl)-3-phenylfuran-2-carboxamide
SMILESCC(O)(CNC(=O)c1occc1-c1ccccc1)CN1CCOCC1
InChIInChI=1S/C19H24N2O4/c1-19(23,14-21-8-11-24-12-9-21)13-20-18(22)17-16(7-10-25-17)15-5-3-2-4-6-15/h2-7,10,23H,8-9,11-14H2,1H3,(H,20,22)
InChIKeyLOWWHECBIRJWQJ-UHFFFAOYSA-N
MW344.41 g/mol
LogP1.76
Rot. Bonds6

About N-(2-hydroxy-2-methyl-3-morpholin-4-ylpropyl)-3-phenylfuran-2-carboxamide

N-(2-hydroxy-2-methyl-3-morpholin-4-ylpropyl)-3-phenylfuran-2-carboxamide (PubChem CID 111698273) has the molecular formula C19H24N2O4 and a molecular weight of 344.41 g/mol. Its IUPAC name is N-(2-hydroxy-2-methyl-3-morpholin-4-ylpropyl)-3-phenylfuran-2-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxy-2-methyl-3-morpholin-4-ylpropyl)-3-phenylfuran-2-carboxamide
PubChem CID111698273
Molecular FormulaC19H24N2O4
Molecular Weight344.41 g/mol
Exact Mass344.17
IUPAC NameN-(2-hydroxy-2-methyl-3-morpholin-4-ylpropyl)-3-phenylfuran-2-carboxamide
SMILESCC(O)(CNC(=O)c1occc1-c1ccccc1)CN1CCOCC1
InChIInChI=1S/C19H24N2O4/c1-19(23,14-21-8-11-24-12-9-21)13-20-18(22)17-16(7-10-25-17)15-5-3-2-4-6-15/h2-7,10,23H,8-9,11-14H2,1H3,(H,20,22)
InChIKeyLOWWHECBIRJWQJ-UHFFFAOYSA-N
XLogP1.76
TPSA74.94 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.41
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-2-methyl-3-morpholin-4-ylpropyl)-3-phenylfuran-2-carboxamide?
The IUPAC name of N-(2-hydroxy-2-methyl-3-morpholin-4-ylpropyl)-3-phenylfuran-2-carboxamide (CID 111698273) is N-(2-hydroxy-2-methyl-3-morpholin-4-ylpropyl)-3-phenylfuran-2-carboxamide.
What is the SMILES notation for N-(2-hydroxy-2-methyl-3-morpholin-4-ylpropyl)-3-phenylfuran-2-carboxamide?
The canonical SMILES for N-(2-hydroxy-2-methyl-3-morpholin-4-ylpropyl)-3-phenylfuran-2-carboxamide is CC(O)(CNC(=O)c1occc1-c1ccccc1)CN1CCOCC1.
What is the InChIKey of N-(2-hydroxy-2-methyl-3-morpholin-4-ylpropyl)-3-phenylfuran-2-carboxamide?
The InChIKey is LOWWHECBIRJWQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O4/c1-19(23,14-21-8-11-24-12-9-21)13-20-18(22)17-16(7-10-25-17)15-5-3-2-4-6-15/h2-7,10,23H,8-9,11-14H2,1H3,(H,20,22).
What are the key properties of N-(2-hydroxy-2-methyl-3-morpholin-4-ylpropyl)-3-phenylfuran-2-carboxamide?
N-(2-hydroxy-2-methyl-3-morpholin-4-ylpropyl)-3-phenylfuran-2-carboxamide has a molecular weight of 344.41 g/mol, XLogP of 1.76, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-2-methyl-3-morpholin-4-ylpropyl)-3-phenylfuran-2-carboxamide is sourced from PubChem (CID 111698273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).