N-(4-chloro-2-fluorophenyl)-2-(1-hydroxycyclopentyl)acetamide

C13H15ClFNO2 — CID 111432127

IUPACN-(4-chloro-2-fluorophenyl)-2-(1-hydroxycyclopentyl)acetamide
SMILESO=C(CC1(O)CCCC1)Nc1ccc(Cl)cc1F
InChIInChI=1S/C13H15ClFNO2/c14-9-3-4-11(10(15)7-9)16-12(17)8-13(18)5-1-2-6-13/h3-4,7,18H,1-2,5-6,8H2,(H,16,17)
InChIKeyXZBHXTMNUITFKF-UHFFFAOYSA-N
MW271.72 g/mol
LogP3.11
Rot. Bonds3

About N-(4-chloro-2-fluorophenyl)-2-(1-hydroxycyclopentyl)acetamide

N-(4-chloro-2-fluorophenyl)-2-(1-hydroxycyclopentyl)acetamide (PubChem CID 111432127) has the molecular formula C13H15ClFNO2 and a molecular weight of 271.72 g/mol. Its IUPAC name is N-(4-chloro-2-fluorophenyl)-2-(1-hydroxycyclopentyl)acetamide.

Molecular Properties

Compound NameN-(4-chloro-2-fluorophenyl)-2-(1-hydroxycyclopentyl)acetamide
PubChem CID111432127
Molecular FormulaC13H15ClFNO2
Molecular Weight271.72 g/mol
Exact Mass271.08
IUPAC NameN-(4-chloro-2-fluorophenyl)-2-(1-hydroxycyclopentyl)acetamide
SMILESO=C(CC1(O)CCCC1)Nc1ccc(Cl)cc1F
InChIInChI=1S/C13H15ClFNO2/c14-9-3-4-11(10(15)7-9)16-12(17)8-13(18)5-1-2-6-13/h3-4,7,18H,1-2,5-6,8H2,(H,16,17)
InChIKeyXZBHXTMNUITFKF-UHFFFAOYSA-N
XLogP3.11
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.72
LogP ≤ 53.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(5-acetamido-2-fluorophenyl)-2-(1-hydroxycyclohexyl)acetamide
CID 111331778
N-(2,3-difluorophenyl)-2-(1-hydroxycyclohexyl)acetamide
CID 111537333
2-(1-hydroxycyclopentyl)-N-[2-oxo-2-(2,3,4-trifluoroanilino)ethyl]acetamide
CID 111430472
N-(2-fluoro-5-pyrrol-1-ylphenyl)-2-(1-hydroxycyclopentyl)acetamide
CID 111537754
2-(1-hydroxycyclopentyl)-N-(2-hydroxy-4-methylphenyl)acetamide
CID 111430326
2-(1-hydroxycyclopentyl)-N-(2-hydroxyphenyl)acetamide
CID 111430337
1-(aminomethyl)-N-(4-chloro-2-fluorophenyl)cyclopropane-1-carboxamide
CID 115452488
N-(3-fluorophenyl)-2-(1-hydroxycyclopentyl)acetamide
CID 111430420
1-(5-chloro-2-fluorophenyl)-3-[(1-hydroxycyclohexyl)methyl]urea
CID 110936278
2-[1-[[2-(4-chloro-2-fluoroanilino)-2-oxoethyl]sulfanylmethyl]cyclopropyl]acetic acid
CID 65444079
N-(4-chloro-2-fluorophenyl)-4-hydroxy-4-(hydroxymethyl)piperidine-1-carboxamide
CID 136553187
N-(4-chloro-2-fluorophenyl)-2-(4-fluorophenyl)acetamide
CID 7961331

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-2-fluorophenyl)-2-(1-hydroxycyclopentyl)acetamide?
The IUPAC name of N-(4-chloro-2-fluorophenyl)-2-(1-hydroxycyclopentyl)acetamide (CID 111432127) is N-(4-chloro-2-fluorophenyl)-2-(1-hydroxycyclopentyl)acetamide.
What is the SMILES notation for N-(4-chloro-2-fluorophenyl)-2-(1-hydroxycyclopentyl)acetamide?
The canonical SMILES for N-(4-chloro-2-fluorophenyl)-2-(1-hydroxycyclopentyl)acetamide is O=C(CC1(O)CCCC1)Nc1ccc(Cl)cc1F.
What is the InChIKey of N-(4-chloro-2-fluorophenyl)-2-(1-hydroxycyclopentyl)acetamide?
The InChIKey is XZBHXTMNUITFKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15ClFNO2/c14-9-3-4-11(10(15)7-9)16-12(17)8-13(18)5-1-2-6-13/h3-4,7,18H,1-2,5-6,8H2,(H,16,17).
What are the key properties of N-(4-chloro-2-fluorophenyl)-2-(1-hydroxycyclopentyl)acetamide?
N-(4-chloro-2-fluorophenyl)-2-(1-hydroxycyclopentyl)acetamide has a molecular weight of 271.72 g/mol, XLogP of 3.11, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-2-fluorophenyl)-2-(1-hydroxycyclopentyl)acetamide is sourced from PubChem (CID 111432127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).