2-cyclopropyl-5-iodo-6-methylpyrimidin-4-amine

C8H10IN3 — CID 66307285

IUPAC2-cyclopropyl-5-iodo-6-methylpyrimidin-4-amine
SMILESCc1nc(C2CC2)nc(N)c1I
InChIInChI=1S/C8H10IN3/c1-4-6(9)7(10)12-8(11-4)5-2-3-5/h5H,2-3H2,1H3,(H2,10,11,12)
InChIKeyYIFQDMYSBMTJDE-UHFFFAOYSA-N
MW275.09 g/mol
LogP1.85
Rot. Bonds1

About 2-cyclopropyl-5-iodo-6-methylpyrimidin-4-amine

2-cyclopropyl-5-iodo-6-methylpyrimidin-4-amine (PubChem CID 66307285) has the molecular formula C8H10IN3 and a molecular weight of 275.09 g/mol. Its IUPAC name is 2-cyclopropyl-5-iodo-6-methylpyrimidin-4-amine.

Molecular Properties

Compound Name2-cyclopropyl-5-iodo-6-methylpyrimidin-4-amine
PubChem CID66307285
Molecular FormulaC8H10IN3
Molecular Weight275.09 g/mol
Exact Mass274.99
IUPAC Name2-cyclopropyl-5-iodo-6-methylpyrimidin-4-amine
SMILESCc1nc(C2CC2)nc(N)c1I
InChIInChI=1S/C8H10IN3/c1-4-6(9)7(10)12-8(11-4)5-2-3-5/h5H,2-3H2,1H3,(H2,10,11,12)
InChIKeyYIFQDMYSBMTJDE-UHFFFAOYSA-N
XLogP1.85
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.09
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-cyclobutyl-5-iodo-6-methylpyrimidin-4-amine
CID 66305298
5-iodo-6-methyl-2-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrimidin-4-amine
CID 66307689
5,6-dimethyl-2-(4-propan-2-ylcyclohexyl)pyrimidin-4-amine
CID 65401369
6-tert-butyl-5-iodo-2-(4-methylcyclohexyl)pyrimidin-4-amine
CID 66306827
2-(4-tert-butylcyclohexyl)-5,6-dimethylpyrimidin-4-amine
CID 65415438
4-chloro-5-iodo-6-methyl-2-(4-methylcyclohexyl)pyrimidine
CID 66294162
5-ethyl-6-methyl-2-(4-methylcyclohexyl)pyrimidin-4-amine
CID 62191021
5-bromo-2-(4-tert-butylcyclohexyl)-6-methylpyrimidin-4-amine
CID 66306252
2-cycloheptyl-5-iodo-6-(methoxymethyl)pyrimidin-4-amine
CID 66304036
6-tert-butyl-2-(4,4-dimethylcyclohexyl)-5-iodopyrimidin-4-amine
CID 66307233
6-cyclopropyl-1,3-dimethylpyrazolo[3,4-d]pyrimidin-4-amine
CID 175246786
[4,6-dimethyl-2-(4-methylcyclohexyl)pyrimidin-5-yl]methanamine
CID 62745432

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-5-iodo-6-methylpyrimidin-4-amine?
The IUPAC name of 2-cyclopropyl-5-iodo-6-methylpyrimidin-4-amine (CID 66307285) is 2-cyclopropyl-5-iodo-6-methylpyrimidin-4-amine.
What is the SMILES notation for 2-cyclopropyl-5-iodo-6-methylpyrimidin-4-amine?
The canonical SMILES for 2-cyclopropyl-5-iodo-6-methylpyrimidin-4-amine is Cc1nc(C2CC2)nc(N)c1I.
What is the InChIKey of 2-cyclopropyl-5-iodo-6-methylpyrimidin-4-amine?
The InChIKey is YIFQDMYSBMTJDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10IN3/c1-4-6(9)7(10)12-8(11-4)5-2-3-5/h5H,2-3H2,1H3,(H2,10,11,12).
What are the key properties of 2-cyclopropyl-5-iodo-6-methylpyrimidin-4-amine?
2-cyclopropyl-5-iodo-6-methylpyrimidin-4-amine has a molecular weight of 275.09 g/mol, XLogP of 1.85, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-5-iodo-6-methylpyrimidin-4-amine is sourced from PubChem (CID 66307285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).