N-[1-(3-fluoro-4-methoxyphenyl)ethyl]furan-2-carboxamide

C14H14FNO3 — CID 18200791

IUPACN-[1-(3-fluoro-4-methoxyphenyl)ethyl]furan-2-carboxamide
SMILESCOc1ccc(C(C)NC(=O)c2ccco2)cc1F
InChIInChI=1S/C14H14FNO3/c1-9(16-14(17)13-4-3-7-19-13)10-5-6-12(18-2)11(15)8-10/h3-9H,1-2H3,(H,16,17)
InChIKeyXEQPAJOWKNASPH-UHFFFAOYSA-N
MW263.27 g/mol
LogP2.92
Rot. Bonds4

About N-[1-(3-fluoro-4-methoxyphenyl)ethyl]furan-2-carboxamide

N-[1-(3-fluoro-4-methoxyphenyl)ethyl]furan-2-carboxamide (PubChem CID 18200791) has the molecular formula C14H14FNO3 and a molecular weight of 263.27 g/mol. Its IUPAC name is N-[1-(3-fluoro-4-methoxyphenyl)ethyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[1-(3-fluoro-4-methoxyphenyl)ethyl]furan-2-carboxamide
PubChem CID18200791
Molecular FormulaC14H14FNO3
Molecular Weight263.27 g/mol
Exact Mass263.10
IUPAC NameN-[1-(3-fluoro-4-methoxyphenyl)ethyl]furan-2-carboxamide
SMILESCOc1ccc(C(C)NC(=O)c2ccco2)cc1F
InChIInChI=1S/C14H14FNO3/c1-9(16-14(17)13-4-3-7-19-13)10-5-6-12(18-2)11(15)8-10/h3-9H,1-2H3,(H,16,17)
InChIKeyXEQPAJOWKNASPH-UHFFFAOYSA-N
XLogP2.92
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.27
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-fluoro-N-[(1R)-1-(furan-2-yl)ethyl]-4-methoxybenzamide
CID 9482281
N-[1-(3-fluoro-4-methoxyphenyl)ethyl]-3,4,5-trimethoxybenzamide
CID 46655748
N-[1-(3-fluoro-4-methoxyphenyl)ethyl]-3,5-dimethoxybenzamide
CID 17397646
4-chloro-N-[(1S)-1-(3-fluoro-4-methoxyphenyl)ethyl]benzamide
CID 9051353
N-[(1S)-1-(3-fluoro-4-methoxyphenyl)ethyl]-2,2-diphenylacetamide
CID 9051417
N-[(1R)-1-(3-fluoro-4-methoxyphenyl)ethyl]-3-(2-methylpropyl)-1,2-oxazole-5-carboxamide
CID 97154633
N-[1-(3-fluoro-4-methoxyphenyl)ethyl]-3-(methylsulfinylmethyl)benzamide
CID 86914769
2-fluoro-N-[1-(3-fluoro-4-methoxyphenyl)ethyl]pyridine-3-carboxamide
CID 107358477
N-(2-methoxy-5-propan-2-ylphenyl)furan-2-carboxamide
CID 110776781
N-[1-(4-bromophenyl)ethyl]furan-2-carboxamide
CID 2919180
2,4-dichloro-5-fluoro-N-[1-(3-fluoro-4-methoxyphenyl)ethyl]benzamide
CID 18275060
1-[(1R)-1-(3-fluoro-4-methoxyphenyl)ethyl]-3-[(1S)-2-methyl-1-phenylpropyl]urea
CID 30302598

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-fluoro-4-methoxyphenyl)ethyl]furan-2-carboxamide?
The IUPAC name of N-[1-(3-fluoro-4-methoxyphenyl)ethyl]furan-2-carboxamide (CID 18200791) is N-[1-(3-fluoro-4-methoxyphenyl)ethyl]furan-2-carboxamide.
What is the SMILES notation for N-[1-(3-fluoro-4-methoxyphenyl)ethyl]furan-2-carboxamide?
The canonical SMILES for N-[1-(3-fluoro-4-methoxyphenyl)ethyl]furan-2-carboxamide is COc1ccc(C(C)NC(=O)c2ccco2)cc1F.
What is the InChIKey of N-[1-(3-fluoro-4-methoxyphenyl)ethyl]furan-2-carboxamide?
The InChIKey is XEQPAJOWKNASPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FNO3/c1-9(16-14(17)13-4-3-7-19-13)10-5-6-12(18-2)11(15)8-10/h3-9H,1-2H3,(H,16,17).
What are the key properties of N-[1-(3-fluoro-4-methoxyphenyl)ethyl]furan-2-carboxamide?
N-[1-(3-fluoro-4-methoxyphenyl)ethyl]furan-2-carboxamide has a molecular weight of 263.27 g/mol, XLogP of 2.92, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-fluoro-4-methoxyphenyl)ethyl]furan-2-carboxamide is sourced from PubChem (CID 18200791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).