2-[4-(7-chloroquinoxalin-2-yl)oxyphenoxy]propanamide

C17H14ClN3O3 — CID 10360101

IUPAC2-[4-(7-chloroquinoxalin-2-yl)oxyphenoxy]propanamide
SMILESCC(Oc1ccc(Oc2cnc3ccc(Cl)cc3n2)cc1)C(N)=O
InChIInChI=1S/C17H14ClN3O3/c1-10(17(19)22)23-12-3-5-13(6-4-12)24-16-9-20-14-7-2-11(18)8-15(14)21-16/h2-10H,1H3,(H2,19,22)
InChIKeyZFBXYDIEADZGQW-UHFFFAOYSA-N
MW343.77 g/mol
LogP3.33
Rot. Bonds5

About 2-[4-(7-chloroquinoxalin-2-yl)oxyphenoxy]propanamide

2-[4-(7-chloroquinoxalin-2-yl)oxyphenoxy]propanamide (PubChem CID 10360101) has the molecular formula C17H14ClN3O3 and a molecular weight of 343.77 g/mol. Its IUPAC name is 2-[4-(7-chloroquinoxalin-2-yl)oxyphenoxy]propanamide.

Molecular Properties

Compound Name2-[4-(7-chloroquinoxalin-2-yl)oxyphenoxy]propanamide
PubChem CID10360101
Molecular FormulaC17H14ClN3O3
Molecular Weight343.77 g/mol
Exact Mass343.07
IUPAC Name2-[4-(7-chloroquinoxalin-2-yl)oxyphenoxy]propanamide
SMILESCC(Oc1ccc(Oc2cnc3ccc(Cl)cc3n2)cc1)C(N)=O
InChIInChI=1S/C17H14ClN3O3/c1-10(17(19)22)23-12-3-5-13(6-4-12)24-16-9-20-14-7-2-11(18)8-15(14)21-16/h2-10H,1H3,(H2,19,22)
InChIKeyZFBXYDIEADZGQW-UHFFFAOYSA-N
XLogP3.33
TPSA87.33 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.77
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(7-chloroquinoxalin-2-yl)oxyphenoxy]propanamide?
The IUPAC name of 2-[4-(7-chloroquinoxalin-2-yl)oxyphenoxy]propanamide (CID 10360101) is 2-[4-(7-chloroquinoxalin-2-yl)oxyphenoxy]propanamide.
What is the SMILES notation for 2-[4-(7-chloroquinoxalin-2-yl)oxyphenoxy]propanamide?
The canonical SMILES for 2-[4-(7-chloroquinoxalin-2-yl)oxyphenoxy]propanamide is CC(Oc1ccc(Oc2cnc3ccc(Cl)cc3n2)cc1)C(N)=O.
What is the InChIKey of 2-[4-(7-chloroquinoxalin-2-yl)oxyphenoxy]propanamide?
The InChIKey is ZFBXYDIEADZGQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14ClN3O3/c1-10(17(19)22)23-12-3-5-13(6-4-12)24-16-9-20-14-7-2-11(18)8-15(14)21-16/h2-10H,1H3,(H2,19,22).
What are the key properties of 2-[4-(7-chloroquinoxalin-2-yl)oxyphenoxy]propanamide?
2-[4-(7-chloroquinoxalin-2-yl)oxyphenoxy]propanamide has a molecular weight of 343.77 g/mol, XLogP of 3.33, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(7-chloroquinoxalin-2-yl)oxyphenoxy]propanamide is sourced from PubChem (CID 10360101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).