6-(furan-2-yl)-N-(3-methoxyphenyl)-2-morpholin-4-ylpyridine-3-carboxamide

C21H21N3O4 — CID 126473659

IUPAC6-(furan-2-yl)-N-(3-methoxyphenyl)-2-morpholin-4-ylpyridine-3-carboxamide
SMILESCOc1cccc(NC(=O)c2ccc(-c3ccco3)nc2N2CCOCC2)c1
InChIInChI=1S/C21H21N3O4/c1-26-16-5-2-4-15(14-16)22-21(25)17-7-8-18(19-6-3-11-28-19)23-20(17)24-9-12-27-13-10-24/h2-8,11,14H,9-10,12-13H2,1H3,(H,22,25)
InChIKeyNGHLCTLLCQVNSH-UHFFFAOYSA-N
MW379.42 g/mol
LogP3.44
Rot. Bonds5

About 6-(furan-2-yl)-N-(3-methoxyphenyl)-2-morpholin-4-ylpyridine-3-carboxamide

6-(furan-2-yl)-N-(3-methoxyphenyl)-2-morpholin-4-ylpyridine-3-carboxamide (PubChem CID 126473659) has the molecular formula C21H21N3O4 and a molecular weight of 379.42 g/mol. Its IUPAC name is 6-(furan-2-yl)-N-(3-methoxyphenyl)-2-morpholin-4-ylpyridine-3-carboxamide.

Molecular Properties

Compound Name6-(furan-2-yl)-N-(3-methoxyphenyl)-2-morpholin-4-ylpyridine-3-carboxamide
PubChem CID126473659
Molecular FormulaC21H21N3O4
Molecular Weight379.42 g/mol
Exact Mass379.15
IUPAC Name6-(furan-2-yl)-N-(3-methoxyphenyl)-2-morpholin-4-ylpyridine-3-carboxamide
SMILESCOc1cccc(NC(=O)c2ccc(-c3ccco3)nc2N2CCOCC2)c1
InChIInChI=1S/C21H21N3O4/c1-26-16-5-2-4-15(14-16)22-21(25)17-7-8-18(19-6-3-11-28-19)23-20(17)24-9-12-27-13-10-24/h2-8,11,14H,9-10,12-13H2,1H3,(H,22,25)
InChIKeyNGHLCTLLCQVNSH-UHFFFAOYSA-N
XLogP3.44
TPSA76.83 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.42
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-(furan-2-yl)-N-(3-methoxyphenyl)-2-morpholin-4-ylpyridine-3-carboxamide?
The IUPAC name of 6-(furan-2-yl)-N-(3-methoxyphenyl)-2-morpholin-4-ylpyridine-3-carboxamide (CID 126473659) is 6-(furan-2-yl)-N-(3-methoxyphenyl)-2-morpholin-4-ylpyridine-3-carboxamide.
What is the SMILES notation for 6-(furan-2-yl)-N-(3-methoxyphenyl)-2-morpholin-4-ylpyridine-3-carboxamide?
The canonical SMILES for 6-(furan-2-yl)-N-(3-methoxyphenyl)-2-morpholin-4-ylpyridine-3-carboxamide is COc1cccc(NC(=O)c2ccc(-c3ccco3)nc2N2CCOCC2)c1.
What is the InChIKey of 6-(furan-2-yl)-N-(3-methoxyphenyl)-2-morpholin-4-ylpyridine-3-carboxamide?
The InChIKey is NGHLCTLLCQVNSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N3O4/c1-26-16-5-2-4-15(14-16)22-21(25)17-7-8-18(19-6-3-11-28-19)23-20(17)24-9-12-27-13-10-24/h2-8,11,14H,9-10,12-13H2,1H3,(H,22,25).
What are the key properties of 6-(furan-2-yl)-N-(3-methoxyphenyl)-2-morpholin-4-ylpyridine-3-carboxamide?
6-(furan-2-yl)-N-(3-methoxyphenyl)-2-morpholin-4-ylpyridine-3-carboxamide has a molecular weight of 379.42 g/mol, XLogP of 3.44, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(furan-2-yl)-N-(3-methoxyphenyl)-2-morpholin-4-ylpyridine-3-carboxamide is sourced from PubChem (CID 126473659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).