N-ethyl-4-methyl-6-(5-methyl-3-pyridinyl)pyrimidin-2-amine

C13H16N4 — CID 113297377

IUPACN-ethyl-4-methyl-6-(5-methyl-3-pyridinyl)pyrimidin-2-amine
SMILESCCNc1nc(C)cc(-c2cncc(C)c2)n1
InChIInChI=1S/C13H16N4/c1-4-15-13-16-10(3)6-12(17-13)11-5-9(2)7-14-8-11/h5-8H,4H2,1-3H3,(H,15,16,17)
InChIKeyHPVCTTCCRGRAAL-UHFFFAOYSA-N
MW228.30 g/mol
LogP2.59
Rot. Bonds3

About N-ethyl-4-methyl-6-(5-methyl-3-pyridinyl)pyrimidin-2-amine

N-ethyl-4-methyl-6-(5-methyl-3-pyridinyl)pyrimidin-2-amine (PubChem CID 113297377) has the molecular formula C13H16N4 and a molecular weight of 228.30 g/mol. Its IUPAC name is N-ethyl-4-methyl-6-(5-methyl-3-pyridinyl)pyrimidin-2-amine.

Molecular Properties

Compound NameN-ethyl-4-methyl-6-(5-methyl-3-pyridinyl)pyrimidin-2-amine
PubChem CID113297377
Molecular FormulaC13H16N4
Molecular Weight228.30 g/mol
Exact Mass228.14
IUPAC NameN-ethyl-4-methyl-6-(5-methyl-3-pyridinyl)pyrimidin-2-amine
SMILESCCNc1nc(C)cc(-c2cncc(C)c2)n1
InChIInChI=1S/C13H16N4/c1-4-15-13-16-10(3)6-12(17-13)11-5-9(2)7-14-8-11/h5-8H,4H2,1-3H3,(H,15,16,17)
InChIKeyHPVCTTCCRGRAAL-UHFFFAOYSA-N
XLogP2.59
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.30
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-methyl-6-(5-methyl-3-pyridinyl)pyrimidin-2-amine?
The IUPAC name of N-ethyl-4-methyl-6-(5-methyl-3-pyridinyl)pyrimidin-2-amine (CID 113297377) is N-ethyl-4-methyl-6-(5-methyl-3-pyridinyl)pyrimidin-2-amine.
What is the SMILES notation for N-ethyl-4-methyl-6-(5-methyl-3-pyridinyl)pyrimidin-2-amine?
The canonical SMILES for N-ethyl-4-methyl-6-(5-methyl-3-pyridinyl)pyrimidin-2-amine is CCNc1nc(C)cc(-c2cncc(C)c2)n1.
What is the InChIKey of N-ethyl-4-methyl-6-(5-methyl-3-pyridinyl)pyrimidin-2-amine?
The InChIKey is HPVCTTCCRGRAAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4/c1-4-15-13-16-10(3)6-12(17-13)11-5-9(2)7-14-8-11/h5-8H,4H2,1-3H3,(H,15,16,17).
What are the key properties of N-ethyl-4-methyl-6-(5-methyl-3-pyridinyl)pyrimidin-2-amine?
N-ethyl-4-methyl-6-(5-methyl-3-pyridinyl)pyrimidin-2-amine has a molecular weight of 228.30 g/mol, XLogP of 2.59, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-methyl-6-(5-methyl-3-pyridinyl)pyrimidin-2-amine is sourced from PubChem (CID 113297377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).