6-(4-iodophenoxy)pyrido[2,3-b]pyrazine

C13H8IN3O — CID 78955285

IUPAC6-(4-iodophenoxy)pyrido[2,3-b]pyrazine
SMILESIc1ccc(Oc2ccc3nccnc3n2)cc1
InChIInChI=1S/C13H8IN3O/c14-9-1-3-10(4-2-9)18-12-6-5-11-13(17-12)16-8-7-15-11/h1-8H
InChIKeyPVOUGTGMVQMPIZ-UHFFFAOYSA-N
MW349.13 g/mol
LogP3.42
Rot. Bonds2

About 6-(4-iodophenoxy)pyrido[2,3-b]pyrazine

6-(4-iodophenoxy)pyrido[2,3-b]pyrazine (PubChem CID 78955285) has the molecular formula C13H8IN3O and a molecular weight of 349.13 g/mol. Its IUPAC name is 6-(4-iodophenoxy)pyrido[2,3-b]pyrazine.

Molecular Properties

Compound Name6-(4-iodophenoxy)pyrido[2,3-b]pyrazine
PubChem CID78955285
Molecular FormulaC13H8IN3O
Molecular Weight349.13 g/mol
Exact Mass348.97
IUPAC Name6-(4-iodophenoxy)pyrido[2,3-b]pyrazine
SMILESIc1ccc(Oc2ccc3nccnc3n2)cc1
InChIInChI=1S/C13H8IN3O/c14-9-1-3-10(4-2-9)18-12-6-5-11-13(17-12)16-8-7-15-11/h1-8H
InChIKeyPVOUGTGMVQMPIZ-UHFFFAOYSA-N
XLogP3.42
TPSA47.90 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.13
LogP ≤ 53.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-chloro-N-(3-fluoro-4-methoxyphenyl)-N-methylpyrido[3,2-d]pyrimidin-4-amine
CID 164611321
2-[4-(4-Methoxyphenyl)piperazin-1-yl]quinoxaline
CID 2764806
N-(4-methoxyphenyl)-N,2-dimethylpteridin-4-amine
CID 46883988
6-[(4-methoxy-N-methylanilino)methyl]pteridine-2,4-diamine
CID 44531589
2-chloro-N-(3,5-difluoro-4-methoxyphenyl)-N-methylpyrido[3,2-d]pyrimidin-4-amine
CID 164609055
6-[[(4-Phenoxyphenyl)methylamino]methyl]pteridine-2,4-diamine
CID 168291732
6-(Phenoxazin-10-ylmethyl)pteridine-2,4-diamine
CID 486241
1-(6-Methyl-3-phenoxypyrido[2,3-b]pyrazin-7-yl)-3-phenylurea
CID 137646369
1-Ethyl-3-[3-(4-methoxyanilino)pyrido[2,3-b]pyrazin-6-yl]urea
CID 58881819
US9592235, Example 353
CID 90054645
US9592235, Example 354
CID 90054647
Phenyl 2-(2-pyridinyl)-6-(trifluoromethyl)-4-pyrimidinyl ether
CID 1475723

Frequently Asked Questions

What is the IUPAC name of 6-(4-iodophenoxy)pyrido[2,3-b]pyrazine?
The IUPAC name of 6-(4-iodophenoxy)pyrido[2,3-b]pyrazine (CID 78955285) is 6-(4-iodophenoxy)pyrido[2,3-b]pyrazine.
What is the SMILES notation for 6-(4-iodophenoxy)pyrido[2,3-b]pyrazine?
The canonical SMILES for 6-(4-iodophenoxy)pyrido[2,3-b]pyrazine is Ic1ccc(Oc2ccc3nccnc3n2)cc1.
What is the InChIKey of 6-(4-iodophenoxy)pyrido[2,3-b]pyrazine?
The InChIKey is PVOUGTGMVQMPIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8IN3O/c14-9-1-3-10(4-2-9)18-12-6-5-11-13(17-12)16-8-7-15-11/h1-8H.
What are the key properties of 6-(4-iodophenoxy)pyrido[2,3-b]pyrazine?
6-(4-iodophenoxy)pyrido[2,3-b]pyrazine has a molecular weight of 349.13 g/mol, XLogP of 3.42, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-iodophenoxy)pyrido[2,3-b]pyrazine is sourced from PubChem (CID 78955285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).