N-(1,2-dihydroacenaphthylen-5-yl)-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide

C23H18N2O3 — CID 134024843

IUPACN-(1,2-dihydroacenaphthylen-5-yl)-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide
SMILESO=C(Nc1ccc2c3c(cccc13)CC2)c1ccc(Cn2ccccc2=O)o1
InChIInChI=1S/C23H18N2O3/c26-21-6-1-2-13-25(21)14-17-10-12-20(28-17)23(27)24-19-11-9-16-8-7-15-4-3-5-18(19)22(15)16/h1-6,9-13H,7-8,14H2,(H,24,27)
InChIKeyNAWRHLQHXSULFD-UHFFFAOYSA-N
MW370.41 g/mol
LogP3.99
Rot. Bonds4

About N-(1,2-dihydroacenaphthylen-5-yl)-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide

N-(1,2-dihydroacenaphthylen-5-yl)-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide (PubChem CID 134024843) has the molecular formula C23H18N2O3 and a molecular weight of 370.41 g/mol. Its IUPAC name is N-(1,2-dihydroacenaphthylen-5-yl)-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-(1,2-dihydroacenaphthylen-5-yl)-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide
PubChem CID134024843
Molecular FormulaC23H18N2O3
Molecular Weight370.41 g/mol
Exact Mass370.13
IUPAC NameN-(1,2-dihydroacenaphthylen-5-yl)-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide
SMILESO=C(Nc1ccc2c3c(cccc13)CC2)c1ccc(Cn2ccccc2=O)o1
InChIInChI=1S/C23H18N2O3/c26-21-6-1-2-13-25(21)14-17-10-12-20(28-17)23(27)24-19-11-9-16-8-7-15-4-3-5-18(19)22(15)16/h1-6,9-13H,7-8,14H2,(H,24,27)
InChIKeyNAWRHLQHXSULFD-UHFFFAOYSA-N
XLogP3.99
TPSA64.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.41
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1,2-dihydroacenaphthylen-5-yl)-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide?
The IUPAC name of N-(1,2-dihydroacenaphthylen-5-yl)-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide (CID 134024843) is N-(1,2-dihydroacenaphthylen-5-yl)-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide.
What is the SMILES notation for N-(1,2-dihydroacenaphthylen-5-yl)-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide?
The canonical SMILES for N-(1,2-dihydroacenaphthylen-5-yl)-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide is O=C(Nc1ccc2c3c(cccc13)CC2)c1ccc(Cn2ccccc2=O)o1.
What is the InChIKey of N-(1,2-dihydroacenaphthylen-5-yl)-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide?
The InChIKey is NAWRHLQHXSULFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18N2O3/c26-21-6-1-2-13-25(21)14-17-10-12-20(28-17)23(27)24-19-11-9-16-8-7-15-4-3-5-18(19)22(15)16/h1-6,9-13H,7-8,14H2,(H,24,27).
What are the key properties of N-(1,2-dihydroacenaphthylen-5-yl)-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide?
N-(1,2-dihydroacenaphthylen-5-yl)-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide has a molecular weight of 370.41 g/mol, XLogP of 3.99, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,2-dihydroacenaphthylen-5-yl)-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide is sourced from PubChem (CID 134024843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).