5-iodo-N-methyl-2-(3-methyl-2-pyridinyl)pyrimidin-4-amine

C11H11IN4 — CID 66302903

IUPAC5-iodo-N-methyl-2-(3-methyl-2-pyridinyl)pyrimidin-4-amine
SMILESCNc1nc(-c2ncccc2C)ncc1I
InChIInChI=1S/C11H11IN4/c1-7-4-3-5-14-9(7)11-15-6-8(12)10(13-2)16-11/h3-6H,1-2H3,(H,13,15,16)
InChIKeyLMYINNAJNIYZHJ-UHFFFAOYSA-N
MW326.14 g/mol
LogP2.49
Rot. Bonds2

About 5-iodo-N-methyl-2-(3-methyl-2-pyridinyl)pyrimidin-4-amine

5-iodo-N-methyl-2-(3-methyl-2-pyridinyl)pyrimidin-4-amine (PubChem CID 66302903) has the molecular formula C11H11IN4 and a molecular weight of 326.14 g/mol. Its IUPAC name is 5-iodo-N-methyl-2-(3-methyl-2-pyridinyl)pyrimidin-4-amine.

Molecular Properties

Compound Name5-iodo-N-methyl-2-(3-methyl-2-pyridinyl)pyrimidin-4-amine
PubChem CID66302903
Molecular FormulaC11H11IN4
Molecular Weight326.14 g/mol
Exact Mass326.00
IUPAC Name5-iodo-N-methyl-2-(3-methyl-2-pyridinyl)pyrimidin-4-amine
SMILESCNc1nc(-c2ncccc2C)ncc1I
InChIInChI=1S/C11H11IN4/c1-7-4-3-5-14-9(7)11-15-6-8(12)10(13-2)16-11/h3-6H,1-2H3,(H,13,15,16)
InChIKeyLMYINNAJNIYZHJ-UHFFFAOYSA-N
XLogP2.49
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.14
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 5-iodo-N-methyl-2-(3-methyl-2-pyridinyl)pyrimidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(3-chloro-2-pyridinyl)-5-iodo-N-methylpyrimidin-4-amine
CID 103445166
5-iodo-N-methyl-2-(6-methyl-3-pyridinyl)pyrimidin-4-amine
CID 104823417
N,6-dimethyl-2-(3-methyl-2-pyridinyl)-5-propan-2-ylpyrimidin-4-amine
CID 62915108
2-(2-bromophenyl)-5-iodo-N-methylpyrimidin-4-amine
CID 66301471
N-methyl-2-(3-methyl-2-pyridinyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-amine
CID 106472271
N-ethyl-5-iodo-2-(3-methyl-2-pyridinyl)-6-propylpyrimidin-4-amine
CID 66306784
2-(2-ethylpyrazol-3-yl)-5-iodo-N-methylpyrimidin-4-amine
CID 114557450
2-(3-methyl-2-pyridinyl)pyrimidin-4-amine
CID 62192811
4-amino-2-(3-methyl-2-pyridinyl)pyrimidine-5-carboxamide
CID 116647886
[6-methyl-2-(3-methyl-2-pyridinyl)-5-propan-2-ylpyrimidin-4-yl]hydrazine
CID 62915348
N-methyl-2-(3-methyl-2-pyridinyl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-5-amine
CID 107385127
5-iodo-N-methyl-2-(3-propoxyphenyl)pyrimidin-4-amine
CID 66296662

Frequently Asked Questions

What is the IUPAC name of 5-iodo-N-methyl-2-(3-methyl-2-pyridinyl)pyrimidin-4-amine?
The IUPAC name of 5-iodo-N-methyl-2-(3-methyl-2-pyridinyl)pyrimidin-4-amine (CID 66302903) is 5-iodo-N-methyl-2-(3-methyl-2-pyridinyl)pyrimidin-4-amine.
What is the SMILES notation for 5-iodo-N-methyl-2-(3-methyl-2-pyridinyl)pyrimidin-4-amine?
The canonical SMILES for 5-iodo-N-methyl-2-(3-methyl-2-pyridinyl)pyrimidin-4-amine is CNc1nc(-c2ncccc2C)ncc1I.
What is the InChIKey of 5-iodo-N-methyl-2-(3-methyl-2-pyridinyl)pyrimidin-4-amine?
The InChIKey is LMYINNAJNIYZHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11IN4/c1-7-4-3-5-14-9(7)11-15-6-8(12)10(13-2)16-11/h3-6H,1-2H3,(H,13,15,16).
What are the key properties of 5-iodo-N-methyl-2-(3-methyl-2-pyridinyl)pyrimidin-4-amine?
5-iodo-N-methyl-2-(3-methyl-2-pyridinyl)pyrimidin-4-amine has a molecular weight of 326.14 g/mol, XLogP of 2.49, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-iodo-N-methyl-2-(3-methyl-2-pyridinyl)pyrimidin-4-amine is sourced from PubChem (CID 66302903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).