5-methoxy-2-methyl-N-(5-morpholin-4-yl-2-pyridinyl)-1-benzofuran-3-carboxamide

C20H21N3O4 — CID 55823376

IUPAC5-methoxy-2-methyl-N-(5-morpholin-4-yl-2-pyridinyl)-1-benzofuran-3-carboxamide
SMILESCOc1ccc2oc(C)c(C(=O)Nc3ccc(N4CCOCC4)cn3)c2c1
InChIInChI=1S/C20H21N3O4/c1-13-19(16-11-15(25-2)4-5-17(16)27-13)20(24)22-18-6-3-14(12-21-18)23-7-9-26-10-8-23/h3-6,11-12H,7-10H2,1-2H3,(H,21,22,24)
InChIKeyJJDJMLUVPTZUTB-UHFFFAOYSA-N
MW367.41 g/mol
LogP3.23
Rot. Bonds4

About 5-methoxy-2-methyl-N-(5-morpholin-4-yl-2-pyridinyl)-1-benzofuran-3-carboxamide

5-methoxy-2-methyl-N-(5-morpholin-4-yl-2-pyridinyl)-1-benzofuran-3-carboxamide (PubChem CID 55823376) has the molecular formula C20H21N3O4 and a molecular weight of 367.41 g/mol. Its IUPAC name is 5-methoxy-2-methyl-N-(5-morpholin-4-yl-2-pyridinyl)-1-benzofuran-3-carboxamide.

Molecular Properties

Compound Name5-methoxy-2-methyl-N-(5-morpholin-4-yl-2-pyridinyl)-1-benzofuran-3-carboxamide
PubChem CID55823376
Molecular FormulaC20H21N3O4
Molecular Weight367.41 g/mol
Exact Mass367.15
IUPAC Name5-methoxy-2-methyl-N-(5-morpholin-4-yl-2-pyridinyl)-1-benzofuran-3-carboxamide
SMILESCOc1ccc2oc(C)c(C(=O)Nc3ccc(N4CCOCC4)cn3)c2c1
InChIInChI=1S/C20H21N3O4/c1-13-19(16-11-15(25-2)4-5-17(16)27-13)20(24)22-18-6-3-14(12-21-18)23-7-9-26-10-8-23/h3-6,11-12H,7-10H2,1-2H3,(H,21,22,24)
InChIKeyJJDJMLUVPTZUTB-UHFFFAOYSA-N
XLogP3.23
TPSA76.83 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.41
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-[5-[2-[2-(2-fluoroethoxy)ethoxy]ethoxy]-1-benzofuran-2-yl]-N-methylpyridin-2-amine
CID 52951730
5-[5-[2-[2-(2-(18F)fluoroethoxy)ethoxy]ethoxy]-1-benzofuran-2-yl]-N-methylpyridin-2-amine
CID 52951982
5-methoxy-3-methyl-N-pyridin-2-yl-1-benzofuran-2-carboxamide
CID 16382764
5-ethoxy-3-methyl-N-(4-methylpyridin-2-yl)-1-benzofuran-2-carboxamide
CID 24980288
N-pyridin-2-yl-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide
CID 648450
5-Phenyl-2-trifluoromethyl-furan-3-carboxylic acid (6-morpholin-4-yl-pyridin-3-yl)-amide
CID 16757105
N-(2-fluorophenyl)-4-[5-[(5-methoxy-3-methyl-1-benzofuran-2-carbonyl)amino]-2-pyridinyl]piperazine-1-carboxamide
CID 52917491
(E)-3-[(3R)-3-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-4-oxo-1,2,3,5-tetrahydropyrido[2,3-b][1,4]diazepin-8-yl]-N-methyl-N-[(3-methyl-1-benzofuran-2-yl)methyl]prop-2-enamide
CID 156500220
N-(3-methyl-2-pyridinyl)-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide
CID 655831
5-methoxy-3-methyl-N-(5-methyl-2-pyridinyl)-1-benzofuran-2-carboxamide
CID 24982418
2-[3-[[1-[5-[(3-Methyl-5-phenyl-1-benzofuran-2-carbonyl)amino]-2-pyridinyl]piperidin-4-yl]methoxy]phenyl]acetic acid
CID 71552091
Benzofuran-2-yl-[4-[3-(ethylamino)-2-pyridyl]piperazin-1-yl]methanone
CID 455386

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-2-methyl-N-(5-morpholin-4-yl-2-pyridinyl)-1-benzofuran-3-carboxamide?
The IUPAC name of 5-methoxy-2-methyl-N-(5-morpholin-4-yl-2-pyridinyl)-1-benzofuran-3-carboxamide (CID 55823376) is 5-methoxy-2-methyl-N-(5-morpholin-4-yl-2-pyridinyl)-1-benzofuran-3-carboxamide.
What is the SMILES notation for 5-methoxy-2-methyl-N-(5-morpholin-4-yl-2-pyridinyl)-1-benzofuran-3-carboxamide?
The canonical SMILES for 5-methoxy-2-methyl-N-(5-morpholin-4-yl-2-pyridinyl)-1-benzofuran-3-carboxamide is COc1ccc2oc(C)c(C(=O)Nc3ccc(N4CCOCC4)cn3)c2c1.
What is the InChIKey of 5-methoxy-2-methyl-N-(5-morpholin-4-yl-2-pyridinyl)-1-benzofuran-3-carboxamide?
The InChIKey is JJDJMLUVPTZUTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3O4/c1-13-19(16-11-15(25-2)4-5-17(16)27-13)20(24)22-18-6-3-14(12-21-18)23-7-9-26-10-8-23/h3-6,11-12H,7-10H2,1-2H3,(H,21,22,24).
What are the key properties of 5-methoxy-2-methyl-N-(5-morpholin-4-yl-2-pyridinyl)-1-benzofuran-3-carboxamide?
5-methoxy-2-methyl-N-(5-morpholin-4-yl-2-pyridinyl)-1-benzofuran-3-carboxamide has a molecular weight of 367.41 g/mol, XLogP of 3.23, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-2-methyl-N-(5-morpholin-4-yl-2-pyridinyl)-1-benzofuran-3-carboxamide is sourced from PubChem (CID 55823376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).