2-(3-chloro-2-pyridinyl)-5-iodo-N-methylpyrimidin-4-amine

C10H8ClIN4 — CID 103445166

IUPAC2-(3-chloro-2-pyridinyl)-5-iodo-N-methylpyrimidin-4-amine
SMILESCNc1nc(-c2ncccc2Cl)ncc1I
InChIInChI=1S/C10H8ClIN4/c1-13-9-7(12)5-15-10(16-9)8-6(11)3-2-4-14-8/h2-5H,1H3,(H,13,15,16)
InChIKeyNFEYTYKHNJZCLG-UHFFFAOYSA-N
MW346.56 g/mol
LogP2.84
Rot. Bonds2

About 2-(3-chloro-2-pyridinyl)-5-iodo-N-methylpyrimidin-4-amine

2-(3-chloro-2-pyridinyl)-5-iodo-N-methylpyrimidin-4-amine (PubChem CID 103445166) has the molecular formula C10H8ClIN4 and a molecular weight of 346.56 g/mol. Its IUPAC name is 2-(3-chloro-2-pyridinyl)-5-iodo-N-methylpyrimidin-4-amine.

Molecular Properties

Compound Name2-(3-chloro-2-pyridinyl)-5-iodo-N-methylpyrimidin-4-amine
PubChem CID103445166
Molecular FormulaC10H8ClIN4
Molecular Weight346.56 g/mol
Exact Mass345.95
IUPAC Name2-(3-chloro-2-pyridinyl)-5-iodo-N-methylpyrimidin-4-amine
SMILESCNc1nc(-c2ncccc2Cl)ncc1I
InChIInChI=1S/C10H8ClIN4/c1-13-9-7(12)5-15-10(16-9)8-6(11)3-2-4-14-8/h2-5H,1H3,(H,13,15,16)
InChIKeyNFEYTYKHNJZCLG-UHFFFAOYSA-N
XLogP2.84
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.56
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

5-iodo-N-methyl-2-(3-methyl-2-pyridinyl)pyrimidin-4-amine
CID 66302903
2-(3-chloro-2-pyridinyl)-5-iodo-6-(methoxymethyl)-N-methylpyrimidin-4-amine
CID 103445159
5-iodo-N-methyl-2-(6-methyl-3-pyridinyl)pyrimidin-4-amine
CID 104823417
2-(2-bromophenyl)-5-iodo-N-methylpyrimidin-4-amine
CID 66301471
4,6-dichloro-2-(3-chloro-2-pyridinyl)-5-iodopyrimidine
CID 103443010
2-(2-bromo-5-chlorophenyl)-5-iodo-N-methylpyrimidin-4-amine
CID 66295504
2-(2-ethylpyrazol-3-yl)-5-iodo-N-methylpyrimidin-4-amine
CID 114557450
2-(2-chlorophenyl)-N-ethyl-5-iodopyrimidin-4-amine
CID 66303127
N-[[2-(3-chloro-2-pyridinyl)pyrimidin-5-yl]methyl]ethanamine
CID 103445312
3-chloro-2-(3-chloro-2-pyridinyl)pyridine;palladium(2+)
CID 18935247
2-(3-chloro-2-pyridinyl)-N-ethyl-5-iodo-6-(2-methylpropyl)pyrimidin-4-amine
CID 103445182
5-bromo-2-(3-chloro-2-pyridinyl)pyrimidine-4-carboxylic acid
CID 106512241

Frequently Asked Questions

What is the IUPAC name of 2-(3-chloro-2-pyridinyl)-5-iodo-N-methylpyrimidin-4-amine?
The IUPAC name of 2-(3-chloro-2-pyridinyl)-5-iodo-N-methylpyrimidin-4-amine (CID 103445166) is 2-(3-chloro-2-pyridinyl)-5-iodo-N-methylpyrimidin-4-amine.
What is the SMILES notation for 2-(3-chloro-2-pyridinyl)-5-iodo-N-methylpyrimidin-4-amine?
The canonical SMILES for 2-(3-chloro-2-pyridinyl)-5-iodo-N-methylpyrimidin-4-amine is CNc1nc(-c2ncccc2Cl)ncc1I.
What is the InChIKey of 2-(3-chloro-2-pyridinyl)-5-iodo-N-methylpyrimidin-4-amine?
The InChIKey is NFEYTYKHNJZCLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8ClIN4/c1-13-9-7(12)5-15-10(16-9)8-6(11)3-2-4-14-8/h2-5H,1H3,(H,13,15,16).
What are the key properties of 2-(3-chloro-2-pyridinyl)-5-iodo-N-methylpyrimidin-4-amine?
2-(3-chloro-2-pyridinyl)-5-iodo-N-methylpyrimidin-4-amine has a molecular weight of 346.56 g/mol, XLogP of 2.84, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chloro-2-pyridinyl)-5-iodo-N-methylpyrimidin-4-amine is sourced from PubChem (CID 103445166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).