N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]furan-3-carboxamide

C18H16N2O5 — CID 18102271

IUPACN-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]furan-3-carboxamide
SMILESO=C(Nc1c(C(=O)N2CCOCC2)oc2ccccc12)c1ccoc1
InChIInChI=1S/C18H16N2O5/c21-17(12-5-8-24-11-12)19-15-13-3-1-2-4-14(13)25-16(15)18(22)20-6-9-23-10-7-20/h1-5,8,11H,6-7,9-10H2,(H,19,21)
InChIKeyVHAYIYRNFOOOBH-UHFFFAOYSA-N
MW340.34 g/mol
LogP2.75
Rot. Bonds3

About N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]furan-3-carboxamide

N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]furan-3-carboxamide (PubChem CID 18102271) has the molecular formula C18H16N2O5 and a molecular weight of 340.34 g/mol. Its IUPAC name is N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]furan-3-carboxamide.

Molecular Properties

Compound NameN-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]furan-3-carboxamide
PubChem CID18102271
Molecular FormulaC18H16N2O5
Molecular Weight340.34 g/mol
Exact Mass340.11
IUPAC NameN-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]furan-3-carboxamide
SMILESO=C(Nc1c(C(=O)N2CCOCC2)oc2ccccc12)c1ccoc1
InChIInChI=1S/C18H16N2O5/c21-17(12-5-8-24-11-12)19-15-13-3-1-2-4-14(13)25-16(15)18(22)20-6-9-23-10-7-20/h1-5,8,11H,6-7,9-10H2,(H,19,21)
InChIKeyVHAYIYRNFOOOBH-UHFFFAOYSA-N
XLogP2.75
TPSA84.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.34
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-fluoro-N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]benzamide
CID 7614430
N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]pyridine-4-carboxamide
CID 17419143
2-chloro-N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]benzamide
CID 17462897
(2S)-N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]oxolane-2-carboxamide
CID 95339435
3-(methoxymethyl)-N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]benzamide
CID 18092742
2,4-difluoro-N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]benzamide
CID 7638212
4-(5-methyl-3,4-dihydropyrazol-2-yl)-N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]benzamide
CID 154836602
3-cyclopropyl-N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]propanamide
CID 71931115
2-ethoxy-N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]benzamide
CID 20926220
N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]-5-phenyl-1,2-oxazole-3-carboxamide
CID 55448027
N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]thieno[3,2-b][1]benzothiole-2-carboxamide
CID 112797878
N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]-6,7-dihydro-5H-cyclopenta[b]pyridine-2-carboxamide
CID 167828106

Frequently Asked Questions

What is the IUPAC name of N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]furan-3-carboxamide?
The IUPAC name of N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]furan-3-carboxamide (CID 18102271) is N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]furan-3-carboxamide.
What is the SMILES notation for N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]furan-3-carboxamide?
The canonical SMILES for N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]furan-3-carboxamide is O=C(Nc1c(C(=O)N2CCOCC2)oc2ccccc12)c1ccoc1.
What is the InChIKey of N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]furan-3-carboxamide?
The InChIKey is VHAYIYRNFOOOBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O5/c21-17(12-5-8-24-11-12)19-15-13-3-1-2-4-14(13)25-16(15)18(22)20-6-9-23-10-7-20/h1-5,8,11H,6-7,9-10H2,(H,19,21).
What are the key properties of N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]furan-3-carboxamide?
N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]furan-3-carboxamide has a molecular weight of 340.34 g/mol, XLogP of 2.75, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]furan-3-carboxamide is sourced from PubChem (CID 18102271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).