5-(2-fluorophenyl)-N-(1-hydroxypropan-2-yl)-N-methylfuran-2-carboxamide

C15H16FNO3 — CID 109388419

IUPAC5-(2-fluorophenyl)-N-(1-hydroxypropan-2-yl)-N-methylfuran-2-carboxamide
SMILESCC(CO)N(C)C(=O)c1ccc(-c2ccccc2F)o1
InChIInChI=1S/C15H16FNO3/c1-10(9-18)17(2)15(19)14-8-7-13(20-14)11-5-3-4-6-12(11)16/h3-8,10,18H,9H2,1-2H3
InChIKeyCZKSVTAUEJBAAV-UHFFFAOYSA-N
MW277.30 g/mol
LogP2.54
Rot. Bonds4

About 5-(2-fluorophenyl)-N-(1-hydroxypropan-2-yl)-N-methylfuran-2-carboxamide

5-(2-fluorophenyl)-N-(1-hydroxypropan-2-yl)-N-methylfuran-2-carboxamide (PubChem CID 109388419) has the molecular formula C15H16FNO3 and a molecular weight of 277.30 g/mol. Its IUPAC name is 5-(2-fluorophenyl)-N-(1-hydroxypropan-2-yl)-N-methylfuran-2-carboxamide.

Molecular Properties

Compound Name5-(2-fluorophenyl)-N-(1-hydroxypropan-2-yl)-N-methylfuran-2-carboxamide
PubChem CID109388419
Molecular FormulaC15H16FNO3
Molecular Weight277.30 g/mol
Exact Mass277.11
IUPAC Name5-(2-fluorophenyl)-N-(1-hydroxypropan-2-yl)-N-methylfuran-2-carboxamide
SMILESCC(CO)N(C)C(=O)c1ccc(-c2ccccc2F)o1
InChIInChI=1S/C15H16FNO3/c1-10(9-18)17(2)15(19)14-8-7-13(20-14)11-5-3-4-6-12(11)16/h3-8,10,18H,9H2,1-2H3
InChIKeyCZKSVTAUEJBAAV-UHFFFAOYSA-N
XLogP2.54
TPSA53.68 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.30
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-((3-Methyl-1-benzofuran-2-YL)carbonyl)morpholine
CID 768761
1-(1-Benzofuran-2-ylcarbonyl)-4-methylpiperidine
CID 977492
Furan-2-carboxamide deriv., 17
CID 44236903
[5-(4-Isopropyl-phenoxymethyl)-furan-2-yl]-pyrrolidin-1-yl-methanone
CID 717029
5-(2-methylpropyl)-N-(2-phenoxyethyl)furan-2-carboxamide
CID 5295624
3-[5-[(4-fluorophenyl)methyl]furan-2-carbonyl]-4-hydroxy-1-isopropyl-2H-pyrrol-5-one
CID 513238
2-Benzofuranyl-4-morpholinylmethanone
CID 3819793
1-[(7-Fluoro-3-methyl-1-benzofuran-2-yl)carbonyl]-3-(methoxymethyl)pyrrolidine
CID 23723907
N-[(4-fluorophenyl)methyl]-N-[3-(furan-2-yl)-3-phenylpropyl]furan-2-carboxamide
CID 2965322
4-(2-Furoyl)-1-(2-furylmethyl)-3-hydroxy-5-(3-hydroxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
CID 2934348
1-((3-Methyl-1-benzofuran-2-YL)carbonyl)piperidine
CID 768762
[5-(4-Propyl-phenoxymethyl)-furan-2-yl]-pyrrolidin-1-yl-methanone
CID 1091762

Frequently Asked Questions

What is the IUPAC name of 5-(2-fluorophenyl)-N-(1-hydroxypropan-2-yl)-N-methylfuran-2-carboxamide?
The IUPAC name of 5-(2-fluorophenyl)-N-(1-hydroxypropan-2-yl)-N-methylfuran-2-carboxamide (CID 109388419) is 5-(2-fluorophenyl)-N-(1-hydroxypropan-2-yl)-N-methylfuran-2-carboxamide.
What is the SMILES notation for 5-(2-fluorophenyl)-N-(1-hydroxypropan-2-yl)-N-methylfuran-2-carboxamide?
The canonical SMILES for 5-(2-fluorophenyl)-N-(1-hydroxypropan-2-yl)-N-methylfuran-2-carboxamide is CC(CO)N(C)C(=O)c1ccc(-c2ccccc2F)o1.
What is the InChIKey of 5-(2-fluorophenyl)-N-(1-hydroxypropan-2-yl)-N-methylfuran-2-carboxamide?
The InChIKey is CZKSVTAUEJBAAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FNO3/c1-10(9-18)17(2)15(19)14-8-7-13(20-14)11-5-3-4-6-12(11)16/h3-8,10,18H,9H2,1-2H3.
What are the key properties of 5-(2-fluorophenyl)-N-(1-hydroxypropan-2-yl)-N-methylfuran-2-carboxamide?
5-(2-fluorophenyl)-N-(1-hydroxypropan-2-yl)-N-methylfuran-2-carboxamide has a molecular weight of 277.30 g/mol, XLogP of 2.54, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-fluorophenyl)-N-(1-hydroxypropan-2-yl)-N-methylfuran-2-carboxamide is sourced from PubChem (CID 109388419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).