N-[1-(4-fluorophenoxy)propan-2-yl]-1-hydroxycyclopentane-1-carboxamide

C15H20FNO3 — CID 110907559

IUPACN-[1-(4-fluorophenoxy)propan-2-yl]-1-hydroxycyclopentane-1-carboxamide
SMILESCC(COc1ccc(F)cc1)NC(=O)C1(O)CCCC1
InChIInChI=1S/C15H20FNO3/c1-11(10-20-13-6-4-12(16)5-7-13)17-14(18)15(19)8-2-3-9-15/h4-7,11,19H,2-3,8-10H2,1H3,(H,17,18)
InChIKeyBSVWYMLLEULTOM-UHFFFAOYSA-N
MW281.33 g/mol
LogP2.01
Rot. Bonds5

About N-[1-(4-fluorophenoxy)propan-2-yl]-1-hydroxycyclopentane-1-carboxamide

N-[1-(4-fluorophenoxy)propan-2-yl]-1-hydroxycyclopentane-1-carboxamide (PubChem CID 110907559) has the molecular formula C15H20FNO3 and a molecular weight of 281.33 g/mol. Its IUPAC name is N-[1-(4-fluorophenoxy)propan-2-yl]-1-hydroxycyclopentane-1-carboxamide.

Molecular Properties

Compound NameN-[1-(4-fluorophenoxy)propan-2-yl]-1-hydroxycyclopentane-1-carboxamide
PubChem CID110907559
Molecular FormulaC15H20FNO3
Molecular Weight281.33 g/mol
Exact Mass281.14
IUPAC NameN-[1-(4-fluorophenoxy)propan-2-yl]-1-hydroxycyclopentane-1-carboxamide
SMILESCC(COc1ccc(F)cc1)NC(=O)C1(O)CCCC1
InChIInChI=1S/C15H20FNO3/c1-11(10-20-13-6-4-12(16)5-7-13)17-14(18)15(19)8-2-3-9-15/h4-7,11,19H,2-3,8-10H2,1H3,(H,17,18)
InChIKeyBSVWYMLLEULTOM-UHFFFAOYSA-N
XLogP2.01
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.33
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-fluorophenyl)-N-(1-methoxypropan-2-yl)cyclopentane-1-carboxamide
CID 46642602
N-[(2S)-1-(4-methoxyphenoxy)propan-2-yl]-1-phenylcyclopentane-1-carboxamide
CID 100615641
1-[1-(4-fluorophenoxy)propan-2-yl]-3-[(4-methylphenyl)methyl]urea
CID 60554656
1-amino-N-[1-(2,4-difluorophenoxy)propan-2-yl]cyclopentane-1-carboxamide
CID 119299978
1-amino-N-[1-(2,4-difluorophenoxy)propan-2-yl]cyclopentane-1-carboxamide;hydrochloride
CID 119299977
N-[1-(4-fluorophenoxy)propan-2-yl]-3,3-bis(trifluoromethyl)pyrrolidine-1-carboxamide
CID 86966966
1-amino-N-[1-(3-methylphenoxy)propan-2-yl]cyclopentane-1-carboxamide
CID 119300012
N-[1-(4-fluorophenoxy)propan-2-yl]-3-hydroxy-4-methylpiperidine-1-carboxamide
CID 75441282
2-[1-(4-fluorophenoxy)propan-2-ylcarbamoylamino]-N-propylacetamide
CID 86826839
3-[(2S)-1-(4-fluorophenoxy)propan-2-yl]-1-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]urea
CID 52732451
1-(1-cyclopropylpiperidin-4-yl)-3-[1-(4-fluorophenoxy)propan-2-yl]urea
CID 86826887
1-(2-tert-butylsulfanylethyl)-3-[1-(4-fluorophenoxy)propan-2-yl]urea
CID 86884516

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-fluorophenoxy)propan-2-yl]-1-hydroxycyclopentane-1-carboxamide?
The IUPAC name of N-[1-(4-fluorophenoxy)propan-2-yl]-1-hydroxycyclopentane-1-carboxamide (CID 110907559) is N-[1-(4-fluorophenoxy)propan-2-yl]-1-hydroxycyclopentane-1-carboxamide.
What is the SMILES notation for N-[1-(4-fluorophenoxy)propan-2-yl]-1-hydroxycyclopentane-1-carboxamide?
The canonical SMILES for N-[1-(4-fluorophenoxy)propan-2-yl]-1-hydroxycyclopentane-1-carboxamide is CC(COc1ccc(F)cc1)NC(=O)C1(O)CCCC1.
What is the InChIKey of N-[1-(4-fluorophenoxy)propan-2-yl]-1-hydroxycyclopentane-1-carboxamide?
The InChIKey is BSVWYMLLEULTOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20FNO3/c1-11(10-20-13-6-4-12(16)5-7-13)17-14(18)15(19)8-2-3-9-15/h4-7,11,19H,2-3,8-10H2,1H3,(H,17,18).
What are the key properties of N-[1-(4-fluorophenoxy)propan-2-yl]-1-hydroxycyclopentane-1-carboxamide?
N-[1-(4-fluorophenoxy)propan-2-yl]-1-hydroxycyclopentane-1-carboxamide has a molecular weight of 281.33 g/mol, XLogP of 2.01, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-fluorophenoxy)propan-2-yl]-1-hydroxycyclopentane-1-carboxamide is sourced from PubChem (CID 110907559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).