5-(4-chlorophenoxy)-N-(2-oxo-1,3-oxazolidin-3-yl)pentanamide

C14H17ClN2O4 — CID 162648849

IUPAC5-(4-chlorophenoxy)-N-(2-oxo-1,3-oxazolidin-3-yl)pentanamide
SMILESO=C(CCCCOc1ccc(Cl)cc1)NN1CCOC1=O
InChIInChI=1S/C14H17ClN2O4/c15-11-4-6-12(7-5-11)20-9-2-1-3-13(18)16-17-8-10-21-14(17)19/h4-7H,1-3,8-10H2,(H,16,18)
InChIKeyCXVZEJKOMICXRE-UHFFFAOYSA-N
MW312.75 g/mol
LogP2.37
Rot. Bonds7

About 5-(4-chlorophenoxy)-N-(2-oxo-1,3-oxazolidin-3-yl)pentanamide

5-(4-chlorophenoxy)-N-(2-oxo-1,3-oxazolidin-3-yl)pentanamide (PubChem CID 162648849) has the molecular formula C14H17ClN2O4 and a molecular weight of 312.75 g/mol. Its IUPAC name is 5-(4-chlorophenoxy)-N-(2-oxo-1,3-oxazolidin-3-yl)pentanamide.

Molecular Properties

Compound Name5-(4-chlorophenoxy)-N-(2-oxo-1,3-oxazolidin-3-yl)pentanamide
PubChem CID162648849
Molecular FormulaC14H17ClN2O4
Molecular Weight312.75 g/mol
Exact Mass312.09
IUPAC Name5-(4-chlorophenoxy)-N-(2-oxo-1,3-oxazolidin-3-yl)pentanamide
SMILESO=C(CCCCOc1ccc(Cl)cc1)NN1CCOC1=O
InChIInChI=1S/C14H17ClN2O4/c15-11-4-6-12(7-5-11)20-9-2-1-3-13(18)16-17-8-10-21-14(17)19/h4-7H,1-3,8-10H2,(H,16,18)
InChIKeyCXVZEJKOMICXRE-UHFFFAOYSA-N
XLogP2.37
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.75
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-(4-chlorophenoxy)butanehydrazide
CID 61059745
2-(4-chlorophenyl)-N-(2-oxo-1,3-oxazolidin-3-yl)propanamide
CID 118555124
5-(4-chlorophenoxy)pentanoate
CID 7037411
2-[5-(4-chlorophenoxy)pentanoyl]oxirane-2-carboxylic acid
CID 22367662
5-amino-N-[2-(4-chlorophenoxy)ethoxy]pentanamide
CID 89167610
2-(4-chlorophenoxy)-N-(2,4-dioxoimidazolidin-1-yl)acetamide
CID 4825746
4-chloro-N-[2-(4-chlorophenoxy)ethyl]butanamide
CID 82109522
4-(4-chlorophenoxy)-N-[[4-[(4-methylpiperazin-1-yl)methyl]phenyl]methyl]butanamide
CID 55840604
N-[2-(4-chlorophenoxy)ethyl]-4-phenoxybutanamide
CID 94868069
4-amino-N-[2-(4-chlorophenoxy)ethyl]butanamide;hydrochloride
CID 119271547
4-(4-chlorophenoxy)-N-(4-methylpiperidine-1-carbothioyl)butanamide
CID 19188795
ethyl 7-(4-chlorophenoxy)heptanoate
CID 158846599

Frequently Asked Questions

What is the IUPAC name of 5-(4-chlorophenoxy)-N-(2-oxo-1,3-oxazolidin-3-yl)pentanamide?
The IUPAC name of 5-(4-chlorophenoxy)-N-(2-oxo-1,3-oxazolidin-3-yl)pentanamide (CID 162648849) is 5-(4-chlorophenoxy)-N-(2-oxo-1,3-oxazolidin-3-yl)pentanamide.
What is the SMILES notation for 5-(4-chlorophenoxy)-N-(2-oxo-1,3-oxazolidin-3-yl)pentanamide?
The canonical SMILES for 5-(4-chlorophenoxy)-N-(2-oxo-1,3-oxazolidin-3-yl)pentanamide is O=C(CCCCOc1ccc(Cl)cc1)NN1CCOC1=O.
What is the InChIKey of 5-(4-chlorophenoxy)-N-(2-oxo-1,3-oxazolidin-3-yl)pentanamide?
The InChIKey is CXVZEJKOMICXRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17ClN2O4/c15-11-4-6-12(7-5-11)20-9-2-1-3-13(18)16-17-8-10-21-14(17)19/h4-7H,1-3,8-10H2,(H,16,18).
What are the key properties of 5-(4-chlorophenoxy)-N-(2-oxo-1,3-oxazolidin-3-yl)pentanamide?
5-(4-chlorophenoxy)-N-(2-oxo-1,3-oxazolidin-3-yl)pentanamide has a molecular weight of 312.75 g/mol, XLogP of 2.37, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-chlorophenoxy)-N-(2-oxo-1,3-oxazolidin-3-yl)pentanamide is sourced from PubChem (CID 162648849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).