6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]pyrimidine-2,4-diamine

C12H15N5O — CID 103176389

IUPAC6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]pyrimidine-2,4-diamine
SMILESCCc1nc(C)ccc1Oc1cc(N)nc(N)n1
InChIInChI=1S/C12H15N5O/c1-3-8-9(5-4-7(2)15-8)18-11-6-10(13)16-12(14)17-11/h4-6H,3H2,1-2H3,(H4,13,14,16,17)
InChIKeySQLOHVRCLSYYDM-UHFFFAOYSA-N
MW245.29 g/mol
LogP1.70
Rot. Bonds3

About 6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]pyrimidine-2,4-diamine

6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]pyrimidine-2,4-diamine (PubChem CID 103176389) has the molecular formula C12H15N5O and a molecular weight of 245.29 g/mol. Its IUPAC name is 6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]pyrimidine-2,4-diamine.

Molecular Properties

Compound Name6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]pyrimidine-2,4-diamine
PubChem CID103176389
Molecular FormulaC12H15N5O
Molecular Weight245.29 g/mol
Exact Mass245.13
IUPAC Name6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]pyrimidine-2,4-diamine
SMILESCCc1nc(C)ccc1Oc1cc(N)nc(N)n1
InChIInChI=1S/C12H15N5O/c1-3-8-9(5-4-7(2)15-8)18-11-6-10(13)16-12(14)17-11/h4-6H,3H2,1-2H3,(H4,13,14,16,17)
InChIKeySQLOHVRCLSYYDM-UHFFFAOYSA-N
XLogP1.70
TPSA99.94 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.29
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]pyrimidine-2,4-diamine 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

4-N-ethyl-6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]pyrimidine-2,4-diamine
CID 103176372
6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]pyrimidin-4-amine
CID 103176295
6-(2-tert-butyl-4-ethylphenoxy)pyrimidine-2,4-diamine
CID 80866692
4-ethoxy-6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-1,3,5-triazin-2-amine
CID 103176391
6-(2-chloro-4-methylphenoxy)pyrimidine-2,4-diamine
CID 80878907
4-[(2-ethyl-6-methyl-3-pyridinyl)oxy]thieno[2,3-d]pyrimidin-2-amine
CID 103333669
6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-N-methyl-2-methylsulfanylpyrimidin-4-amine
CID 103176374
3-[(6-chloro-2-pyridinyl)oxy]-2-ethyl-6-methylpyridine
CID 103174660
N-ethyl-6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-2-methylpyrimidin-4-amine
CID 103176355
2-chloro-6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-4-(trifluoromethyl)pyridine
CID 103174626
4-chloro-6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-2-(trifluoromethyl)pyrimidine
CID 106766872
6-(2-fluoro-5-methylphenoxy)pyrimidine-2,4-diamine
CID 80877439

Frequently Asked Questions

What is the IUPAC name of 6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]pyrimidine-2,4-diamine?
The IUPAC name of 6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]pyrimidine-2,4-diamine (CID 103176389) is 6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]pyrimidine-2,4-diamine.
What is the SMILES notation for 6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]pyrimidine-2,4-diamine?
The canonical SMILES for 6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]pyrimidine-2,4-diamine is CCc1nc(C)ccc1Oc1cc(N)nc(N)n1.
What is the InChIKey of 6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]pyrimidine-2,4-diamine?
The InChIKey is SQLOHVRCLSYYDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N5O/c1-3-8-9(5-4-7(2)15-8)18-11-6-10(13)16-12(14)17-11/h4-6H,3H2,1-2H3,(H4,13,14,16,17).
What are the key properties of 6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]pyrimidine-2,4-diamine?
6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]pyrimidine-2,4-diamine has a molecular weight of 245.29 g/mol, XLogP of 1.70, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]pyrimidine-2,4-diamine is sourced from PubChem (CID 103176389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).