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

C18H17N3O3 — CID 134053222

IUPACN-(5-morpholin-4-yl-2-pyridinyl)-1-benzofuran-2-carboxamide
SMILESO=C(Nc1ccc(N2CCOCC2)cn1)c1cc2ccccc2o1
InChIInChI=1S/C18H17N3O3/c22-18(16-11-13-3-1-2-4-15(13)24-16)20-17-6-5-14(12-19-17)21-7-9-23-10-8-21/h1-6,11-12H,7-10H2,(H,19,20,22)
InChIKeyNEHJYVHHIHXNQP-UHFFFAOYSA-N
MW323.35 g/mol
LogP2.92
Rot. Bonds3

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

N-(5-morpholin-4-yl-2-pyridinyl)-1-benzofuran-2-carboxamide (PubChem CID 134053222) has the molecular formula C18H17N3O3 and a molecular weight of 323.35 g/mol. Its IUPAC name is N-(5-morpholin-4-yl-2-pyridinyl)-1-benzofuran-2-carboxamide.

Molecular Properties

Compound NameN-(5-morpholin-4-yl-2-pyridinyl)-1-benzofuran-2-carboxamide
PubChem CID134053222
Molecular FormulaC18H17N3O3
Molecular Weight323.35 g/mol
Exact Mass323.13
IUPAC NameN-(5-morpholin-4-yl-2-pyridinyl)-1-benzofuran-2-carboxamide
SMILESO=C(Nc1ccc(N2CCOCC2)cn1)c1cc2ccccc2o1
InChIInChI=1S/C18H17N3O3/c22-18(16-11-13-3-1-2-4-15(13)24-16)20-17-6-5-14(12-19-17)21-7-9-23-10-8-21/h1-6,11-12H,7-10H2,(H,19,20,22)
InChIKeyNEHJYVHHIHXNQP-UHFFFAOYSA-N
XLogP2.92
TPSA67.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.35
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(5-morpholin-4-yl-2-pyridinyl)-2-oxochromene-3-carboxamide
CID 47020558
5-bromo-N-(5-morpholin-4-yl-2-pyridinyl)-1-benzofuran-2-carboxamide
CID 55651490
N-(5-iodo-2-pyridinyl)-1-benzofuran-2-carboxamide
CID 6459983
N-(5-amino-2-morpholin-4-ylphenyl)-1-benzofuran-2-carboxamide
CID 28692731
3-chloro-N-(5-morpholin-4-yl-2-pyridinyl)benzamide
CID 38139828
5-methyl-N-(5-morpholin-4-yl-2-pyridinyl)-2-phenyl-1,3-oxazole-4-carboxamide
CID 38139634
N-[4-[(5-morpholin-4-yl-2-pyridinyl)carbamoyl]phenyl]furan-2-carboxamide
CID 55540208
2-chloro-N-(5-morpholin-4-yl-2-pyridinyl)pyridine-4-carboxamide
CID 33447939
N-[2-[(5-morpholin-4-yl-2-pyridinyl)amino]-2-oxoethyl]benzamide
CID 38141318
3,4,5,6-tetrachloro-N-(5-morpholin-4-yl-2-pyridinyl)pyridine-2-carboxamide
CID 56573813
4-fluoro-3,5-dimethyl-N-(5-morpholin-4-yl-2-pyridinyl)benzamide
CID 146084918
2-(difluoromethoxy)-N-(5-morpholin-4-yl-2-pyridinyl)benzamide
CID 25345280

Frequently Asked Questions

What is the IUPAC name of N-(5-morpholin-4-yl-2-pyridinyl)-1-benzofuran-2-carboxamide?
The IUPAC name of N-(5-morpholin-4-yl-2-pyridinyl)-1-benzofuran-2-carboxamide (CID 134053222) is N-(5-morpholin-4-yl-2-pyridinyl)-1-benzofuran-2-carboxamide.
What is the SMILES notation for N-(5-morpholin-4-yl-2-pyridinyl)-1-benzofuran-2-carboxamide?
The canonical SMILES for N-(5-morpholin-4-yl-2-pyridinyl)-1-benzofuran-2-carboxamide is O=C(Nc1ccc(N2CCOCC2)cn1)c1cc2ccccc2o1.
What is the InChIKey of N-(5-morpholin-4-yl-2-pyridinyl)-1-benzofuran-2-carboxamide?
The InChIKey is NEHJYVHHIHXNQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O3/c22-18(16-11-13-3-1-2-4-15(13)24-16)20-17-6-5-14(12-19-17)21-7-9-23-10-8-21/h1-6,11-12H,7-10H2,(H,19,20,22).
What are the key properties of N-(5-morpholin-4-yl-2-pyridinyl)-1-benzofuran-2-carboxamide?
N-(5-morpholin-4-yl-2-pyridinyl)-1-benzofuran-2-carboxamide has a molecular weight of 323.35 g/mol, XLogP of 2.92, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-morpholin-4-yl-2-pyridinyl)-1-benzofuran-2-carboxamide is sourced from PubChem (CID 134053222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).