N-(cyclopentylcarbamoyl)-2-(2,3,5,6-tetrafluorophenoxy)acetamide

C14H14F4N2O3 — CID 2544312

IUPACN-(cyclopentylcarbamoyl)-2-(2,3,5,6-tetrafluorophenoxy)acetamide
SMILESO=C(COc1c(F)c(F)cc(F)c1F)NC(=O)NC1CCCC1
InChIInChI=1S/C14H14F4N2O3/c15-8-5-9(16)12(18)13(11(8)17)23-6-10(21)20-14(22)19-7-3-1-2-4-7/h5,7H,1-4,6H2,(H2,19,20,21,22)
InChIKeyRMJLNLKUMDKMQO-UHFFFAOYSA-N
MW334.27 g/mol
LogP2.39
Rot. Bonds4

About N-(cyclopentylcarbamoyl)-2-(2,3,5,6-tetrafluorophenoxy)acetamide

N-(cyclopentylcarbamoyl)-2-(2,3,5,6-tetrafluorophenoxy)acetamide (PubChem CID 2544312) has the molecular formula C14H14F4N2O3 and a molecular weight of 334.27 g/mol. Its IUPAC name is N-(cyclopentylcarbamoyl)-2-(2,3,5,6-tetrafluorophenoxy)acetamide.

Molecular Properties

Compound NameN-(cyclopentylcarbamoyl)-2-(2,3,5,6-tetrafluorophenoxy)acetamide
PubChem CID2544312
Molecular FormulaC14H14F4N2O3
Molecular Weight334.27 g/mol
Exact Mass334.09
IUPAC NameN-(cyclopentylcarbamoyl)-2-(2,3,5,6-tetrafluorophenoxy)acetamide
SMILESO=C(COc1c(F)c(F)cc(F)c1F)NC(=O)NC1CCCC1
InChIInChI=1S/C14H14F4N2O3/c15-8-5-9(16)12(18)13(11(8)17)23-6-10(21)20-14(22)19-7-3-1-2-4-7/h5,7H,1-4,6H2,(H2,19,20,21,22)
InChIKeyRMJLNLKUMDKMQO-UHFFFAOYSA-N
XLogP2.39
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.27
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}

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Related Compounds

N-(methylcarbamoyl)-2-(2,3,5,6-tetrafluorophenoxy)acetamide
CID 2544310
2-(2-fluorophenoxy)-N-(methylcarbamoyl)propanamide
CID 4690424
N-(propan-2-ylcarbamoyl)-2-(2,3,5,6-tetrafluorophenoxy)acetamide
CID 2544256
N-(3-methylbutylcarbamoyl)-2-(2,3,5,6-tetrafluorophenoxy)acetamide
CID 2544321
N-(propylcarbamoyl)-2-(2,3,5,6-tetrafluorophenoxy)acetamide
CID 2544332
2-(2-bromophenoxy)-N-(cyclopentylcarbamoyl)acetamide
CID 7847650
N-(2-methylpropylcarbamoyl)-2-(2,3,5,6-tetrafluorophenoxy)acetamide
CID 2544330
Urea, (2-(2,6-difluorophenoxy)ethyl)-
CID 208992
2-(3-chloro-4-fluorophenoxy)-N-(cyclopentylcarbamoyl)acetamide
CID 2641654
1-Cyclohexyl-3-[2-(4-fluorophenoxy)ethyl]urea
CID 44054612
1-[1-(2,4-Difluorophenoxy)propan-2-yl]-3-(2-methoxyethyl)urea
CID 47377619
N-cyclohexyl-2-(2-fluorophenoxy)acetamide
CID 6473167

Frequently Asked Questions

What is the IUPAC name of N-(cyclopentylcarbamoyl)-2-(2,3,5,6-tetrafluorophenoxy)acetamide?
The IUPAC name of N-(cyclopentylcarbamoyl)-2-(2,3,5,6-tetrafluorophenoxy)acetamide (CID 2544312) is N-(cyclopentylcarbamoyl)-2-(2,3,5,6-tetrafluorophenoxy)acetamide.
What is the SMILES notation for N-(cyclopentylcarbamoyl)-2-(2,3,5,6-tetrafluorophenoxy)acetamide?
The canonical SMILES for N-(cyclopentylcarbamoyl)-2-(2,3,5,6-tetrafluorophenoxy)acetamide is O=C(COc1c(F)c(F)cc(F)c1F)NC(=O)NC1CCCC1.
What is the InChIKey of N-(cyclopentylcarbamoyl)-2-(2,3,5,6-tetrafluorophenoxy)acetamide?
The InChIKey is RMJLNLKUMDKMQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14F4N2O3/c15-8-5-9(16)12(18)13(11(8)17)23-6-10(21)20-14(22)19-7-3-1-2-4-7/h5,7H,1-4,6H2,(H2,19,20,21,22).
What are the key properties of N-(cyclopentylcarbamoyl)-2-(2,3,5,6-tetrafluorophenoxy)acetamide?
N-(cyclopentylcarbamoyl)-2-(2,3,5,6-tetrafluorophenoxy)acetamide has a molecular weight of 334.27 g/mol, XLogP of 2.39, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopentylcarbamoyl)-2-(2,3,5,6-tetrafluorophenoxy)acetamide is sourced from PubChem (CID 2544312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).