N-[(1R)-1-(2-fluorophenyl)ethyl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide

C19H17FN2O3 — CID 31343638

IUPACN-[(1R)-1-(2-fluorophenyl)ethyl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide
SMILESC[C@@H](NC(=O)c1ccc(Cn2ccccc2=O)o1)c1ccccc1F
InChIInChI=1S/C19H17FN2O3/c1-13(15-6-2-3-7-16(15)20)21-19(24)17-10-9-14(25-17)12-22-11-5-4-8-18(22)23/h2-11,13H,12H2,1H3,(H,21,24)/t13-/m1/s1
InChIKeyJJMRFYGJDBIVDZ-CYBMUJFWSA-N
MW340.35 g/mol
LogP3.12
Rot. Bonds5

About N-[(1R)-1-(2-fluorophenyl)ethyl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide

N-[(1R)-1-(2-fluorophenyl)ethyl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide (PubChem CID 31343638) has the molecular formula C19H17FN2O3 and a molecular weight of 340.35 g/mol. Its IUPAC name is N-[(1R)-1-(2-fluorophenyl)ethyl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[(1R)-1-(2-fluorophenyl)ethyl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide
PubChem CID31343638
Molecular FormulaC19H17FN2O3
Molecular Weight340.35 g/mol
Exact Mass340.12
IUPAC NameN-[(1R)-1-(2-fluorophenyl)ethyl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide
SMILESC[C@@H](NC(=O)c1ccc(Cn2ccccc2=O)o1)c1ccccc1F
InChIInChI=1S/C19H17FN2O3/c1-13(15-6-2-3-7-16(15)20)21-19(24)17-10-9-14(25-17)12-22-11-5-4-8-18(22)23/h2-11,13H,12H2,1H3,(H,21,24)/t13-/m1/s1
InChIKeyJJMRFYGJDBIVDZ-CYBMUJFWSA-N
XLogP3.12
TPSA64.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.35
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-(2-fluorophenyl)ethyl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide?
The IUPAC name of N-[(1R)-1-(2-fluorophenyl)ethyl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide (CID 31343638) is N-[(1R)-1-(2-fluorophenyl)ethyl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide.
What is the SMILES notation for N-[(1R)-1-(2-fluorophenyl)ethyl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide?
The canonical SMILES for N-[(1R)-1-(2-fluorophenyl)ethyl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide is C[C@@H](NC(=O)c1ccc(Cn2ccccc2=O)o1)c1ccccc1F.
What is the InChIKey of N-[(1R)-1-(2-fluorophenyl)ethyl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide?
The InChIKey is JJMRFYGJDBIVDZ-CYBMUJFWSA-N. The full InChI is InChI=1S/C19H17FN2O3/c1-13(15-6-2-3-7-16(15)20)21-19(24)17-10-9-14(25-17)12-22-11-5-4-8-18(22)23/h2-11,13H,12H2,1H3,(H,21,24)/t13-/m1/s1.
What are the key properties of N-[(1R)-1-(2-fluorophenyl)ethyl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide?
N-[(1R)-1-(2-fluorophenyl)ethyl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide has a molecular weight of 340.35 g/mol, XLogP of 3.12, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-(2-fluorophenyl)ethyl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide is sourced from PubChem (CID 31343638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).