5-(4-fluorophenyl)-N-[(2-hydroxycyclopentyl)methyl]-N-methylfuran-2-carboxamide

C18H20FNO3 — CID 109399945

IUPAC5-(4-fluorophenyl)-N-[(2-hydroxycyclopentyl)methyl]-N-methylfuran-2-carboxamide
SMILESCN(CC1CCCC1O)C(=O)c1ccc(-c2ccc(F)cc2)o1
InChIInChI=1S/C18H20FNO3/c1-20(11-13-3-2-4-15(13)21)18(22)17-10-9-16(23-17)12-5-7-14(19)8-6-12/h5-10,13,15,21H,2-4,11H2,1H3
InChIKeyLOBSMLDMYWXHIY-UHFFFAOYSA-N
MW317.36 g/mol
LogP3.32
Rot. Bonds4

About 5-(4-fluorophenyl)-N-[(2-hydroxycyclopentyl)methyl]-N-methylfuran-2-carboxamide

5-(4-fluorophenyl)-N-[(2-hydroxycyclopentyl)methyl]-N-methylfuran-2-carboxamide (PubChem CID 109399945) has the molecular formula C18H20FNO3 and a molecular weight of 317.36 g/mol. Its IUPAC name is 5-(4-fluorophenyl)-N-[(2-hydroxycyclopentyl)methyl]-N-methylfuran-2-carboxamide.

Molecular Properties

Compound Name5-(4-fluorophenyl)-N-[(2-hydroxycyclopentyl)methyl]-N-methylfuran-2-carboxamide
PubChem CID109399945
Molecular FormulaC18H20FNO3
Molecular Weight317.36 g/mol
Exact Mass317.14
IUPAC Name5-(4-fluorophenyl)-N-[(2-hydroxycyclopentyl)methyl]-N-methylfuran-2-carboxamide
SMILESCN(CC1CCCC1O)C(=O)c1ccc(-c2ccc(F)cc2)o1
InChIInChI=1S/C18H20FNO3/c1-20(11-13-3-2-4-15(13)21)18(22)17-10-9-16(23-17)12-5-7-14(19)8-6-12/h5-10,13,15,21H,2-4,11H2,1H3
InChIKeyLOBSMLDMYWXHIY-UHFFFAOYSA-N
XLogP3.32
TPSA53.68 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.36
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2-hydroxycyclopentyl)methyl]-5-(methoxymethyl)-N-methylfuran-2-carboxamide
CID 109399958
N-cyclopropyl-5-(4-fluorophenyl)-N-[(4-fluorophenyl)methyl]furan-2-carboxamide
CID 18133644
N-[(3,4-dimethoxyphenyl)methyl]-5-(4-fluorophenyl)-N-methylfuran-2-carboxamide
CID 18111620
N-[(2-hydroxycyclohexyl)methyl]-N-methyl-5-phenoxyfuran-2-carboxamide
CID 110003438
5-(4-fluorophenyl)-N-methyl-N-[[5-[(1S,2R)-2-methylcyclopropyl]furan-2-yl]methyl]furan-2-carboxamide
CID 37155018
5-(4-fluorophenyl)-N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]furan-2-carboxamide
CID 8967449
2-[2-(4-fluorophenyl)-1,3-oxazol-4-yl]-N-[(2-hydroxycyclopentyl)methyl]-N-methylacetamide
CID 109400397
1-(4-fluorophenyl)-4-hydroxy-N-[(2-hydroxycyclopentyl)methyl]-N-methylpyrazole-3-carboxamide
CID 109416456
3-[(2,5-difluorophenyl)methyl]-1-[(2-hydroxycyclopentyl)methyl]-1-methylurea
CID 109398607
1-[5-(4-fluorophenyl)furan-2-yl]propan-1-one
CID 62632212
[5-(4-fluorophenyl)furan-2-yl]-(2-methylpiperidin-1-yl)methanone
CID 24537508
5-(4-fluorophenyl)-N-(2-methylcyclohexyl)furan-2-carboxamide
CID 24502726

Frequently Asked Questions

What is the IUPAC name of 5-(4-fluorophenyl)-N-[(2-hydroxycyclopentyl)methyl]-N-methylfuran-2-carboxamide?
The IUPAC name of 5-(4-fluorophenyl)-N-[(2-hydroxycyclopentyl)methyl]-N-methylfuran-2-carboxamide (CID 109399945) is 5-(4-fluorophenyl)-N-[(2-hydroxycyclopentyl)methyl]-N-methylfuran-2-carboxamide.
What is the SMILES notation for 5-(4-fluorophenyl)-N-[(2-hydroxycyclopentyl)methyl]-N-methylfuran-2-carboxamide?
The canonical SMILES for 5-(4-fluorophenyl)-N-[(2-hydroxycyclopentyl)methyl]-N-methylfuran-2-carboxamide is CN(CC1CCCC1O)C(=O)c1ccc(-c2ccc(F)cc2)o1.
What is the InChIKey of 5-(4-fluorophenyl)-N-[(2-hydroxycyclopentyl)methyl]-N-methylfuran-2-carboxamide?
The InChIKey is LOBSMLDMYWXHIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20FNO3/c1-20(11-13-3-2-4-15(13)21)18(22)17-10-9-16(23-17)12-5-7-14(19)8-6-12/h5-10,13,15,21H,2-4,11H2,1H3.
What are the key properties of 5-(4-fluorophenyl)-N-[(2-hydroxycyclopentyl)methyl]-N-methylfuran-2-carboxamide?
5-(4-fluorophenyl)-N-[(2-hydroxycyclopentyl)methyl]-N-methylfuran-2-carboxamide has a molecular weight of 317.36 g/mol, XLogP of 3.32, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-fluorophenyl)-N-[(2-hydroxycyclopentyl)methyl]-N-methylfuran-2-carboxamide is sourced from PubChem (CID 109399945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).