6-(2-iodo-5-methylphenoxy)pyrido[2,3-b]pyrazine

C14H10IN3O — CID 133355817

IUPAC6-(2-iodo-5-methylphenoxy)pyrido[2,3-b]pyrazine
SMILESCc1ccc(I)c(Oc2ccc3nccnc3n2)c1
InChIInChI=1S/C14H10IN3O/c1-9-2-3-10(15)12(8-9)19-13-5-4-11-14(18-13)17-7-6-16-11/h2-8H,1H3
InChIKeyFDHZWCGNTGNNFN-UHFFFAOYSA-N
MW363.16 g/mol
LogP3.73
Rot. Bonds2

About 6-(2-iodo-5-methylphenoxy)pyrido[2,3-b]pyrazine

6-(2-iodo-5-methylphenoxy)pyrido[2,3-b]pyrazine (PubChem CID 133355817) has the molecular formula C14H10IN3O and a molecular weight of 363.16 g/mol. Its IUPAC name is 6-(2-iodo-5-methylphenoxy)pyrido[2,3-b]pyrazine.

Molecular Properties

Compound Name6-(2-iodo-5-methylphenoxy)pyrido[2,3-b]pyrazine
PubChem CID133355817
Molecular FormulaC14H10IN3O
Molecular Weight363.16 g/mol
Exact Mass362.99
IUPAC Name6-(2-iodo-5-methylphenoxy)pyrido[2,3-b]pyrazine
SMILESCc1ccc(I)c(Oc2ccc3nccnc3n2)c1
InChIInChI=1S/C14H10IN3O/c1-9-2-3-10(15)12(8-9)19-13-5-4-11-14(18-13)17-7-6-16-11/h2-8H,1H3
InChIKeyFDHZWCGNTGNNFN-UHFFFAOYSA-N
XLogP3.73
TPSA47.90 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.16
LogP ≤ 53.73
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-cyclopropyl-4-(2-iodo-5-methylphenoxy)pyrimidine
CID 133355776
6-(4-iodophenoxy)pyrido[2,3-b]pyrazine
CID 78955285
6-(4-bromo-3-methylphenoxy)pyrido[2,3-b]pyrazine
CID 81333354
2-methyl-3-pyrido[2,3-b]pyrazin-6-yloxybenzoic acid
CID 82810748
methyl 3-fluoro-4-methyl-5-pyrido[2,3-b]pyrazin-6-yloxybenzoate
CID 167770946
N-(4-methylphenyl)-3-pyrido[2,3-b]pyrazin-6-yloxybenzamide
CID 133301621
2-(2-pyrido[2,3-b]pyrazin-6-yloxyphenyl)ethanol
CID 107713779
4-(2-iodo-5-methylphenoxy)-2-(methoxymethyl)-6-methylpyrimidine
CID 133355815
6-methylpyrido[2,3-b]pyrazine
CID 10419316
3-bromo-5-pyrido[2,3-b]pyrazin-6-yloxyaniline
CID 103589174
2-butoxy-1-iodo-4-methylbenzene
CID 174551219
3-(difluoromethyl)-6-(2-iodo-5-methylphenoxy)-[1,2,4]triazolo[4,3-b]pyridazine
CID 133428558

Frequently Asked Questions

What is the IUPAC name of 6-(2-iodo-5-methylphenoxy)pyrido[2,3-b]pyrazine?
The IUPAC name of 6-(2-iodo-5-methylphenoxy)pyrido[2,3-b]pyrazine (CID 133355817) is 6-(2-iodo-5-methylphenoxy)pyrido[2,3-b]pyrazine.
What is the SMILES notation for 6-(2-iodo-5-methylphenoxy)pyrido[2,3-b]pyrazine?
The canonical SMILES for 6-(2-iodo-5-methylphenoxy)pyrido[2,3-b]pyrazine is Cc1ccc(I)c(Oc2ccc3nccnc3n2)c1.
What is the InChIKey of 6-(2-iodo-5-methylphenoxy)pyrido[2,3-b]pyrazine?
The InChIKey is FDHZWCGNTGNNFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10IN3O/c1-9-2-3-10(15)12(8-9)19-13-5-4-11-14(18-13)17-7-6-16-11/h2-8H,1H3.
What are the key properties of 6-(2-iodo-5-methylphenoxy)pyrido[2,3-b]pyrazine?
6-(2-iodo-5-methylphenoxy)pyrido[2,3-b]pyrazine has a molecular weight of 363.16 g/mol, XLogP of 3.73, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-iodo-5-methylphenoxy)pyrido[2,3-b]pyrazine is sourced from PubChem (CID 133355817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).