N-(6-methyl-2-pyridinyl)-5-(naphthalen-1-yloxymethyl)furan-2-carboxamide

C22H18N2O3 — CID 1223044

IUPACN-(6-methyl-2-pyridinyl)-5-(naphthalen-1-yloxymethyl)furan-2-carboxamide
SMILESCc1cccc(NC(=O)c2ccc(COc3cccc4ccccc34)o2)n1
InChIInChI=1S/C22H18N2O3/c1-15-6-4-11-21(23-15)24-22(25)20-13-12-17(27-20)14-26-19-10-5-8-16-7-2-3-9-18(16)19/h2-13H,14H2,1H3,(H,23,24,25)
InChIKeyWCCNFPVENIZKLF-UHFFFAOYSA-N
MW358.40 g/mol
LogP4.97
Rot. Bonds5

About N-(6-methyl-2-pyridinyl)-5-(naphthalen-1-yloxymethyl)furan-2-carboxamide

N-(6-methyl-2-pyridinyl)-5-(naphthalen-1-yloxymethyl)furan-2-carboxamide (PubChem CID 1223044) has the molecular formula C22H18N2O3 and a molecular weight of 358.40 g/mol. Its IUPAC name is N-(6-methyl-2-pyridinyl)-5-(naphthalen-1-yloxymethyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(6-methyl-2-pyridinyl)-5-(naphthalen-1-yloxymethyl)furan-2-carboxamide
PubChem CID1223044
Molecular FormulaC22H18N2O3
Molecular Weight358.40 g/mol
Exact Mass358.13
IUPAC NameN-(6-methyl-2-pyridinyl)-5-(naphthalen-1-yloxymethyl)furan-2-carboxamide
SMILESCc1cccc(NC(=O)c2ccc(COc3cccc4ccccc34)o2)n1
InChIInChI=1S/C22H18N2O3/c1-15-6-4-11-21(23-15)24-22(25)20-13-12-17(27-20)14-26-19-10-5-8-16-7-2-3-9-18(16)19/h2-13H,14H2,1H3,(H,23,24,25)
InChIKeyWCCNFPVENIZKLF-UHFFFAOYSA-N
XLogP4.97
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.40
LogP ≤ 54.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(6-methyl-2-pyridinyl)-5-(naphthalen-1-yloxymethyl)furan-2-carboxamide?
The IUPAC name of N-(6-methyl-2-pyridinyl)-5-(naphthalen-1-yloxymethyl)furan-2-carboxamide (CID 1223044) is N-(6-methyl-2-pyridinyl)-5-(naphthalen-1-yloxymethyl)furan-2-carboxamide.
What is the SMILES notation for N-(6-methyl-2-pyridinyl)-5-(naphthalen-1-yloxymethyl)furan-2-carboxamide?
The canonical SMILES for N-(6-methyl-2-pyridinyl)-5-(naphthalen-1-yloxymethyl)furan-2-carboxamide is Cc1cccc(NC(=O)c2ccc(COc3cccc4ccccc34)o2)n1.
What is the InChIKey of N-(6-methyl-2-pyridinyl)-5-(naphthalen-1-yloxymethyl)furan-2-carboxamide?
The InChIKey is WCCNFPVENIZKLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N2O3/c1-15-6-4-11-21(23-15)24-22(25)20-13-12-17(27-20)14-26-19-10-5-8-16-7-2-3-9-18(16)19/h2-13H,14H2,1H3,(H,23,24,25).
What are the key properties of N-(6-methyl-2-pyridinyl)-5-(naphthalen-1-yloxymethyl)furan-2-carboxamide?
N-(6-methyl-2-pyridinyl)-5-(naphthalen-1-yloxymethyl)furan-2-carboxamide has a molecular weight of 358.40 g/mol, XLogP of 4.97, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methyl-2-pyridinyl)-5-(naphthalen-1-yloxymethyl)furan-2-carboxamide is sourced from PubChem (CID 1223044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).