N-[1-(3-fluoro-4-methoxyphenyl)ethyl]-3-[5-(4-methoxyphenyl)furan-2-yl]propanamide

C23H24FNO4 — CID 42921818

IUPACN-[1-(3-fluoro-4-methoxyphenyl)ethyl]-3-[5-(4-methoxyphenyl)furan-2-yl]propanamide
SMILESCOc1ccc(-c2ccc(CCC(=O)NC(C)c3ccc(OC)c(F)c3)o2)cc1
InChIInChI=1S/C23H24FNO4/c1-15(17-6-11-22(28-3)20(24)14-17)25-23(26)13-10-19-9-12-21(29-19)16-4-7-18(27-2)8-5-16/h4-9,11-12,14-15H,10,13H2,1-3H3,(H,25,26)
InChIKeySRXLKQNTJWTQJW-UHFFFAOYSA-N
MW397.45 g/mol
LogP4.91
Rot. Bonds8

About N-[1-(3-fluoro-4-methoxyphenyl)ethyl]-3-[5-(4-methoxyphenyl)furan-2-yl]propanamide

N-[1-(3-fluoro-4-methoxyphenyl)ethyl]-3-[5-(4-methoxyphenyl)furan-2-yl]propanamide (PubChem CID 42921818) has the molecular formula C23H24FNO4 and a molecular weight of 397.45 g/mol. Its IUPAC name is N-[1-(3-fluoro-4-methoxyphenyl)ethyl]-3-[5-(4-methoxyphenyl)furan-2-yl]propanamide.

Molecular Properties

Compound NameN-[1-(3-fluoro-4-methoxyphenyl)ethyl]-3-[5-(4-methoxyphenyl)furan-2-yl]propanamide
PubChem CID42921818
Molecular FormulaC23H24FNO4
Molecular Weight397.45 g/mol
Exact Mass397.17
IUPAC NameN-[1-(3-fluoro-4-methoxyphenyl)ethyl]-3-[5-(4-methoxyphenyl)furan-2-yl]propanamide
SMILESCOc1ccc(-c2ccc(CCC(=O)NC(C)c3ccc(OC)c(F)c3)o2)cc1
InChIInChI=1S/C23H24FNO4/c1-15(17-6-11-22(28-3)20(24)14-17)25-23(26)13-10-19-9-12-21(29-19)16-4-7-18(27-2)8-5-16/h4-9,11-12,14-15H,10,13H2,1-3H3,(H,25,26)
InChIKeySRXLKQNTJWTQJW-UHFFFAOYSA-N
XLogP4.91
TPSA60.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.45
LogP ≤ 54.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(2,4-difluorophenyl)ethyl]-3-[5-(4-methoxyphenyl)furan-2-yl]propanamide
CID 42921779
3-[5-(4-methoxyphenyl)furan-2-yl]-N-[(1R)-1-(4-methylsulfonylphenyl)ethyl]propanamide
CID 26010955
N-[1-(3-fluoro-4-methoxyphenyl)ethyl]-3-(2-fluorophenyl)propanamide
CID 46828547
N-[1-(3-fluoro-4-methoxyphenyl)ethyl]-2-(4-methoxyphenoxy)acetamide
CID 18118290
N-[1-(3,4-difluorophenyl)ethyl]-3-(3-fluoro-4-methoxyphenyl)propanamide
CID 51275714
3-(2-chlorophenyl)-N-[1-(3-fluoro-4-methoxyphenyl)ethyl]propanamide
CID 46674104
N-(2-methoxy-5-methylphenyl)-3-[5-(4-methoxyphenyl)furan-2-yl]propanamide
CID 24524655
N-[(1R)-1-(3-fluoro-4-methoxyphenyl)ethyl]-3-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)propanamide
CID 39945984
3-(4-chlorophenoxy)-N-[(1S)-1-(3-fluoro-4-methoxyphenyl)ethyl]propanamide
CID 51947174
N-[2-(3,4-dimethoxyphenyl)ethyl]-3-[5-(4-methoxyphenyl)furan-2-yl]propanamide
CID 27286046
N-[1-[1-(difluoromethyl)benzimidazol-2-yl]ethyl]-3-[5-(4-methoxyphenyl)furan-2-yl]propanamide
CID 24597912
N-(3,5-dimethylphenyl)-3-[5-(4-methoxyphenyl)furan-2-yl]propanamide
CID 22587459

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-fluoro-4-methoxyphenyl)ethyl]-3-[5-(4-methoxyphenyl)furan-2-yl]propanamide?
The IUPAC name of N-[1-(3-fluoro-4-methoxyphenyl)ethyl]-3-[5-(4-methoxyphenyl)furan-2-yl]propanamide (CID 42921818) is N-[1-(3-fluoro-4-methoxyphenyl)ethyl]-3-[5-(4-methoxyphenyl)furan-2-yl]propanamide.
What is the SMILES notation for N-[1-(3-fluoro-4-methoxyphenyl)ethyl]-3-[5-(4-methoxyphenyl)furan-2-yl]propanamide?
The canonical SMILES for N-[1-(3-fluoro-4-methoxyphenyl)ethyl]-3-[5-(4-methoxyphenyl)furan-2-yl]propanamide is COc1ccc(-c2ccc(CCC(=O)NC(C)c3ccc(OC)c(F)c3)o2)cc1.
What is the InChIKey of N-[1-(3-fluoro-4-methoxyphenyl)ethyl]-3-[5-(4-methoxyphenyl)furan-2-yl]propanamide?
The InChIKey is SRXLKQNTJWTQJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24FNO4/c1-15(17-6-11-22(28-3)20(24)14-17)25-23(26)13-10-19-9-12-21(29-19)16-4-7-18(27-2)8-5-16/h4-9,11-12,14-15H,10,13H2,1-3H3,(H,25,26).
What are the key properties of N-[1-(3-fluoro-4-methoxyphenyl)ethyl]-3-[5-(4-methoxyphenyl)furan-2-yl]propanamide?
N-[1-(3-fluoro-4-methoxyphenyl)ethyl]-3-[5-(4-methoxyphenyl)furan-2-yl]propanamide has a molecular weight of 397.45 g/mol, XLogP of 4.91, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-fluoro-4-methoxyphenyl)ethyl]-3-[5-(4-methoxyphenyl)furan-2-yl]propanamide is sourced from PubChem (CID 42921818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).