5-(2-fluorophenyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]furan-2-carboxamide

C19H23FN2O3 — CID 120888903

IUPAC5-(2-fluorophenyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]furan-2-carboxamide
SMILESCOCC1(CNC(=O)c2ccc(-c3ccccc3F)o2)CCNCC1
InChIInChI=1S/C19H23FN2O3/c1-24-13-19(8-10-21-11-9-19)12-22-18(23)17-7-6-16(25-17)14-4-2-3-5-15(14)20/h2-7,21H,8-13H2,1H3,(H,22,23)
InChIKeyOPVJMCCRAVLXAV-UHFFFAOYSA-N
MW346.40 g/mol
LogP2.83
Rot. Bonds6

About 5-(2-fluorophenyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]furan-2-carboxamide

5-(2-fluorophenyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]furan-2-carboxamide (PubChem CID 120888903) has the molecular formula C19H23FN2O3 and a molecular weight of 346.40 g/mol. Its IUPAC name is 5-(2-fluorophenyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]furan-2-carboxamide.

Molecular Properties

Compound Name5-(2-fluorophenyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]furan-2-carboxamide
PubChem CID120888903
Molecular FormulaC19H23FN2O3
Molecular Weight346.40 g/mol
Exact Mass346.17
IUPAC Name5-(2-fluorophenyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]furan-2-carboxamide
SMILESCOCC1(CNC(=O)c2ccc(-c3ccccc3F)o2)CCNCC1
InChIInChI=1S/C19H23FN2O3/c1-24-13-19(8-10-21-11-9-19)12-22-18(23)17-7-6-16(25-17)14-4-2-3-5-15(14)20/h2-7,21H,8-13H2,1H3,(H,22,23)
InChIKeyOPVJMCCRAVLXAV-UHFFFAOYSA-N
XLogP2.83
TPSA63.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.40
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

A 317920
CID 10389213
CL82198
CID 2777
4-Tert-butyl-N-(2-furylmethyl)benzamide
CID 674888
Ave5638
CID 9801235
JNJ-27390467 free base
CID 24180717
1-[5-(4-Chlorophenyl)-2-furoyl]piperazine
CID 24857857
Furan-2-carboxamide deriv., 17
CID 44236903
Furan-2-carboxamide deriv., 19
CID 44236905
2N-methyl-4N-(4-oxidanylcyclohexyl)-5-[(1S)-1-phenylethyl]furan-2,4-dicarboxamide
CID 146434124
5-[(4-tert-butylphenoxy)methyl]-N-isopropyl-2-furamide
CID 892519
5-[(4-tert-butylphenoxy)methyl]-N-propyl-2-furamide
CID 2166341
5-(2-methylpropyl)-N-(2-phenoxyethyl)furan-2-carboxamide
CID 5295624

Frequently Asked Questions

What is the IUPAC name of 5-(2-fluorophenyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]furan-2-carboxamide?
The IUPAC name of 5-(2-fluorophenyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]furan-2-carboxamide (CID 120888903) is 5-(2-fluorophenyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]furan-2-carboxamide.
What is the SMILES notation for 5-(2-fluorophenyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]furan-2-carboxamide?
The canonical SMILES for 5-(2-fluorophenyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]furan-2-carboxamide is COCC1(CNC(=O)c2ccc(-c3ccccc3F)o2)CCNCC1.
What is the InChIKey of 5-(2-fluorophenyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]furan-2-carboxamide?
The InChIKey is OPVJMCCRAVLXAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23FN2O3/c1-24-13-19(8-10-21-11-9-19)12-22-18(23)17-7-6-16(25-17)14-4-2-3-5-15(14)20/h2-7,21H,8-13H2,1H3,(H,22,23).
What are the key properties of 5-(2-fluorophenyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]furan-2-carboxamide?
5-(2-fluorophenyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]furan-2-carboxamide has a molecular weight of 346.40 g/mol, XLogP of 2.83, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-fluorophenyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]furan-2-carboxamide is sourced from PubChem (CID 120888903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).