5-(2-fluorophenyl)-N-[(1-hydroxycyclopentyl)methyl]furan-2-carboxamide

C17H18FNO3 — CID 111333061

IUPAC5-(2-fluorophenyl)-N-[(1-hydroxycyclopentyl)methyl]furan-2-carboxamide
SMILESO=C(NCC1(O)CCCC1)c1ccc(-c2ccccc2F)o1
InChIInChI=1S/C17H18FNO3/c18-13-6-2-1-5-12(13)14-7-8-15(22-14)16(20)19-11-17(21)9-3-4-10-17/h1-2,5-8,21H,3-4,9-11H2,(H,19,20)
InChIKeyGJSUIURAHHBOMB-UHFFFAOYSA-N
MW303.33 g/mol
LogP3.12
Rot. Bonds4

About 5-(2-fluorophenyl)-N-[(1-hydroxycyclopentyl)methyl]furan-2-carboxamide

5-(2-fluorophenyl)-N-[(1-hydroxycyclopentyl)methyl]furan-2-carboxamide (PubChem CID 111333061) has the molecular formula C17H18FNO3 and a molecular weight of 303.33 g/mol. Its IUPAC name is 5-(2-fluorophenyl)-N-[(1-hydroxycyclopentyl)methyl]furan-2-carboxamide.

Molecular Properties

Compound Name5-(2-fluorophenyl)-N-[(1-hydroxycyclopentyl)methyl]furan-2-carboxamide
PubChem CID111333061
Molecular FormulaC17H18FNO3
Molecular Weight303.33 g/mol
Exact Mass303.13
IUPAC Name5-(2-fluorophenyl)-N-[(1-hydroxycyclopentyl)methyl]furan-2-carboxamide
SMILESO=C(NCC1(O)CCCC1)c1ccc(-c2ccccc2F)o1
InChIInChI=1S/C17H18FNO3/c18-13-6-2-1-5-12(13)14-7-8-15(22-14)16(20)19-11-17(21)9-3-4-10-17/h1-2,5-8,21H,3-4,9-11H2,(H,19,20)
InChIKeyGJSUIURAHHBOMB-UHFFFAOYSA-N
XLogP3.12
TPSA62.47 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.33
LogP ≤ 53.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-(2-fluorophenyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]furan-2-carboxamide
CID 120888903
5-(2-fluorophenyl)-N-(2-hydroxypropyl)furan-2-carboxamide
CID 78803666
5-(2-fluorophenyl)-N-(2-methylpropyl)furan-2-carboxamide
CID 18106013
7-fluoro-N-[(1-hydroxycyclohexyl)methyl]-1-benzofuran-2-carboxamide
CID 111485827
N-[2-(3,4-dihydroxyphenyl)ethyl]-5-(2-fluorophenyl)furan-2-carboxamide
CID 78799931
5-ethyl-N-[(1-hydroxycyclohexyl)methyl]furan-2-carboxamide
CID 64868940
5-(2-fluorophenyl)-N-(2-pyridin-2-ylethyl)furan-2-carboxamide
CID 51180762
N-(3-amino-2-methylpropyl)-5-(2-fluorophenyl)furan-2-carboxamide;hydrochloride
CID 119996463
N-(2-amino-2-ethylbutyl)-5-(2-fluorophenyl)furan-2-carboxamide;hydrochloride
CID 119640271
N-[3-(cyclopropylmethoxy)propyl]-5-(2-fluorophenyl)furan-2-carboxamide
CID 51222770
N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-5-(2-fluorophenyl)furan-2-carboxamide
CID 51109880
N-[2-(aminomethyl)cyclopentyl]-5-(2-fluorophenyl)furan-2-carboxamide;hydrochloride
CID 119601230

Frequently Asked Questions

What is the IUPAC name of 5-(2-fluorophenyl)-N-[(1-hydroxycyclopentyl)methyl]furan-2-carboxamide?
The IUPAC name of 5-(2-fluorophenyl)-N-[(1-hydroxycyclopentyl)methyl]furan-2-carboxamide (CID 111333061) is 5-(2-fluorophenyl)-N-[(1-hydroxycyclopentyl)methyl]furan-2-carboxamide.
What is the SMILES notation for 5-(2-fluorophenyl)-N-[(1-hydroxycyclopentyl)methyl]furan-2-carboxamide?
The canonical SMILES for 5-(2-fluorophenyl)-N-[(1-hydroxycyclopentyl)methyl]furan-2-carboxamide is O=C(NCC1(O)CCCC1)c1ccc(-c2ccccc2F)o1.
What is the InChIKey of 5-(2-fluorophenyl)-N-[(1-hydroxycyclopentyl)methyl]furan-2-carboxamide?
The InChIKey is GJSUIURAHHBOMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18FNO3/c18-13-6-2-1-5-12(13)14-7-8-15(22-14)16(20)19-11-17(21)9-3-4-10-17/h1-2,5-8,21H,3-4,9-11H2,(H,19,20).
What are the key properties of 5-(2-fluorophenyl)-N-[(1-hydroxycyclopentyl)methyl]furan-2-carboxamide?
5-(2-fluorophenyl)-N-[(1-hydroxycyclopentyl)methyl]furan-2-carboxamide has a molecular weight of 303.33 g/mol, XLogP of 3.12, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-fluorophenyl)-N-[(1-hydroxycyclopentyl)methyl]furan-2-carboxamide is sourced from PubChem (CID 111333061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).