2-chloro-N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]benzamide

C20H17ClN2O4 — CID 17462897

IUPAC2-chloro-N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]benzamide
SMILESO=C(Nc1c(C(=O)N2CCOCC2)oc2ccccc12)c1ccccc1Cl
InChIInChI=1S/C20H17ClN2O4/c21-15-7-3-1-5-13(15)19(24)22-17-14-6-2-4-8-16(14)27-18(17)20(25)23-9-11-26-12-10-23/h1-8H,9-12H2,(H,22,24)
InChIKeyMWNVRLPFHJFFGE-UHFFFAOYSA-N
MW384.82 g/mol
LogP3.81
Rot. Bonds3

About 2-chloro-N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]benzamide

2-chloro-N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]benzamide (PubChem CID 17462897) has the molecular formula C20H17ClN2O4 and a molecular weight of 384.82 g/mol. Its IUPAC name is 2-chloro-N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]benzamide.

Molecular Properties

Compound Name2-chloro-N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]benzamide
PubChem CID17462897
Molecular FormulaC20H17ClN2O4
Molecular Weight384.82 g/mol
Exact Mass384.09
IUPAC Name2-chloro-N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]benzamide
SMILESO=C(Nc1c(C(=O)N2CCOCC2)oc2ccccc12)c1ccccc1Cl
InChIInChI=1S/C20H17ClN2O4/c21-15-7-3-1-5-13(15)19(24)22-17-14-6-2-4-8-16(14)27-18(17)20(25)23-9-11-26-12-10-23/h1-8H,9-12H2,(H,22,24)
InChIKeyMWNVRLPFHJFFGE-UHFFFAOYSA-N
XLogP3.81
TPSA71.78 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.82
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]benzamide?
The IUPAC name of 2-chloro-N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]benzamide (CID 17462897) is 2-chloro-N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]benzamide.
What is the SMILES notation for 2-chloro-N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]benzamide?
The canonical SMILES for 2-chloro-N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]benzamide is O=C(Nc1c(C(=O)N2CCOCC2)oc2ccccc12)c1ccccc1Cl.
What is the InChIKey of 2-chloro-N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]benzamide?
The InChIKey is MWNVRLPFHJFFGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17ClN2O4/c21-15-7-3-1-5-13(15)19(24)22-17-14-6-2-4-8-16(14)27-18(17)20(25)23-9-11-26-12-10-23/h1-8H,9-12H2,(H,22,24).
What are the key properties of 2-chloro-N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]benzamide?
2-chloro-N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]benzamide has a molecular weight of 384.82 g/mol, XLogP of 3.81, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]benzamide is sourced from PubChem (CID 17462897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).