N-[(2-ethoxy-4-pyridinyl)methyl]-9-oxofluorene-2-carboxamide

C22H18N2O3 — CID 55723662

IUPACN-[(2-ethoxy-4-pyridinyl)methyl]-9-oxofluorene-2-carboxamide
SMILESCCOc1cc(CNC(=O)c2ccc3c(c2)C(=O)c2ccccc2-3)ccn1
InChIInChI=1S/C22H18N2O3/c1-2-27-20-11-14(9-10-23-20)13-24-22(26)15-7-8-17-16-5-3-4-6-18(16)21(25)19(17)12-15/h3-12H,2,13H2,1H3,(H,24,26)
InChIKeyNFIKTMZXUFYRJA-UHFFFAOYSA-N
MW358.40 g/mol
LogP3.62
Rot. Bonds5

About N-[(2-ethoxy-4-pyridinyl)methyl]-9-oxofluorene-2-carboxamide

N-[(2-ethoxy-4-pyridinyl)methyl]-9-oxofluorene-2-carboxamide (PubChem CID 55723662) has the molecular formula C22H18N2O3 and a molecular weight of 358.40 g/mol. Its IUPAC name is N-[(2-ethoxy-4-pyridinyl)methyl]-9-oxofluorene-2-carboxamide.

Molecular Properties

Compound NameN-[(2-ethoxy-4-pyridinyl)methyl]-9-oxofluorene-2-carboxamide
PubChem CID55723662
Molecular FormulaC22H18N2O3
Molecular Weight358.40 g/mol
Exact Mass358.13
IUPAC NameN-[(2-ethoxy-4-pyridinyl)methyl]-9-oxofluorene-2-carboxamide
SMILESCCOc1cc(CNC(=O)c2ccc3c(c2)C(=O)c2ccccc2-3)ccn1
InChIInChI=1S/C22H18N2O3/c1-2-27-20-11-14(9-10-23-20)13-24-22(26)15-7-8-17-16-5-3-4-6-18(16)21(25)19(17)12-15/h3-12H,2,13H2,1H3,(H,24,26)
InChIKeyNFIKTMZXUFYRJA-UHFFFAOYSA-N
XLogP3.62
TPSA68.29 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 ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2-ethoxy-4-pyridinyl)methyl]-6-phenoxypyridine-3-carboxamide
CID 78899959
N-ethyl-9,10-dioxoanthracene-2-carboxamide
CID 102014872
N-[(3-carbamoylphenyl)methyl]-9-oxofluorene-2-carboxamide
CID 32637447
3-(2-chlorophenyl)-N-[(2-ethoxy-4-pyridinyl)methyl]-5-methyl-1,2-oxazole-4-carboxamide
CID 78875899
N-[(2-ethoxy-4-pyridinyl)methyl]-3-piperidin-1-ylsulfonylbenzamide
CID 55707675
N-[[5-fluoro-6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]-9-oxofluorene-2-carboxamide
CID 134149975
N-[(2-ethoxy-4-pyridinyl)methyl]-4-(furan-2-ylmethylsulfamoyl)benzamide
CID 55707674
N-[(2-phenylmethoxy-4-pyridinyl)methyl]benzamide
CID 46466541
N-[(2-ethoxy-4-pyridinyl)methyl]-1-benzothiophene-2-carboxamide
CID 52606280
4-(3,5-dimethylpyrazol-1-yl)-N-[(2-ethoxy-4-pyridinyl)methyl]benzamide
CID 55716054
N-[(2-ethoxy-4-pyridinyl)methyl]-3-(2-methylpiperidin-1-yl)sulfonylbenzamide
CID 55707761
N-[(4-nitrophenyl)methyl]-9-oxofluorene-2-carboxamide
CID 55900128

Frequently Asked Questions

What is the IUPAC name of N-[(2-ethoxy-4-pyridinyl)methyl]-9-oxofluorene-2-carboxamide?
The IUPAC name of N-[(2-ethoxy-4-pyridinyl)methyl]-9-oxofluorene-2-carboxamide (CID 55723662) is N-[(2-ethoxy-4-pyridinyl)methyl]-9-oxofluorene-2-carboxamide.
What is the SMILES notation for N-[(2-ethoxy-4-pyridinyl)methyl]-9-oxofluorene-2-carboxamide?
The canonical SMILES for N-[(2-ethoxy-4-pyridinyl)methyl]-9-oxofluorene-2-carboxamide is CCOc1cc(CNC(=O)c2ccc3c(c2)C(=O)c2ccccc2-3)ccn1.
What is the InChIKey of N-[(2-ethoxy-4-pyridinyl)methyl]-9-oxofluorene-2-carboxamide?
The InChIKey is NFIKTMZXUFYRJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N2O3/c1-2-27-20-11-14(9-10-23-20)13-24-22(26)15-7-8-17-16-5-3-4-6-18(16)21(25)19(17)12-15/h3-12H,2,13H2,1H3,(H,24,26).
What are the key properties of N-[(2-ethoxy-4-pyridinyl)methyl]-9-oxofluorene-2-carboxamide?
N-[(2-ethoxy-4-pyridinyl)methyl]-9-oxofluorene-2-carboxamide has a molecular weight of 358.40 g/mol, XLogP of 3.62, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-ethoxy-4-pyridinyl)methyl]-9-oxofluorene-2-carboxamide is sourced from PubChem (CID 55723662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).