4-(2-methyl-4-pyridinyl)-6-propan-2-yloxy-1,3,5-triazin-2-amine

C12H15N5O — CID 113482951

IUPAC4-(2-methyl-4-pyridinyl)-6-propan-2-yloxy-1,3,5-triazin-2-amine
SMILESCc1cc(-c2nc(N)nc(OC(C)C)n2)ccn1
InChIInChI=1S/C12H15N5O/c1-7(2)18-12-16-10(15-11(13)17-12)9-4-5-14-8(3)6-9/h4-7H,1-3H3,(H2,13,15,16,17)
InChIKeyCYDJJBQEYDPIKY-UHFFFAOYSA-N
MW245.29 g/mol
LogP1.61
Rot. Bonds3

About 4-(2-methyl-4-pyridinyl)-6-propan-2-yloxy-1,3,5-triazin-2-amine

4-(2-methyl-4-pyridinyl)-6-propan-2-yloxy-1,3,5-triazin-2-amine (PubChem CID 113482951) has the molecular formula C12H15N5O and a molecular weight of 245.29 g/mol. Its IUPAC name is 4-(2-methyl-4-pyridinyl)-6-propan-2-yloxy-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-(2-methyl-4-pyridinyl)-6-propan-2-yloxy-1,3,5-triazin-2-amine
PubChem CID113482951
Molecular FormulaC12H15N5O
Molecular Weight245.29 g/mol
Exact Mass245.13
IUPAC Name4-(2-methyl-4-pyridinyl)-6-propan-2-yloxy-1,3,5-triazin-2-amine
SMILESCc1cc(-c2nc(N)nc(OC(C)C)n2)ccn1
InChIInChI=1S/C12H15N5O/c1-7(2)18-12-16-10(15-11(13)17-12)9-4-5-14-8(3)6-9/h4-7H,1-3H3,(H2,13,15,16,17)
InChIKeyCYDJJBQEYDPIKY-UHFFFAOYSA-N
XLogP1.61
TPSA86.81 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.29
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-chloro-6-(2-methyl-4-pyridinyl)-1,3,5-triazin-2-amine
CID 106754507
4-methyl-6-(2-methyl-4-pyridinyl)pyrimidin-2-amine
CID 71225444
(1R)-1-[3-(2-methyl-4-pyridinyl)-1,2,4-thiadiazol-5-yl]ethanamine
CID 166760947
4-(3,4-difluorophenyl)sulfanyl-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 80887729
4-(4-bromo-3-chloro-2-fluorophenyl)-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 106763689
2-chloro-4-(3-chloro-4-fluorophenyl)-6-propan-2-yloxy-1,3,5-triazine
CID 115504443
4-chloro-6-(3-propan-2-yloxyphenyl)-1,3,5-triazin-2-amine
CID 83240232
4-propan-2-yloxy-6-(4-propan-2-ylphenyl)sulfanyl-1,3,5-triazin-2-amine
CID 80872521
4-(4-fluorophenyl)sulfanyl-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 80883341
4-(5-bromo-2-methylphenoxy)-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 107287473
4-methoxy-6-(4-methylphenyl)-1,3,5-triazin-2-amine;hydrochloride
CID 175949920
4-(2,3-dimethylphenoxy)-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 80863931

Frequently Asked Questions

What is the IUPAC name of 4-(2-methyl-4-pyridinyl)-6-propan-2-yloxy-1,3,5-triazin-2-amine?
The IUPAC name of 4-(2-methyl-4-pyridinyl)-6-propan-2-yloxy-1,3,5-triazin-2-amine (CID 113482951) is 4-(2-methyl-4-pyridinyl)-6-propan-2-yloxy-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-(2-methyl-4-pyridinyl)-6-propan-2-yloxy-1,3,5-triazin-2-amine?
The canonical SMILES for 4-(2-methyl-4-pyridinyl)-6-propan-2-yloxy-1,3,5-triazin-2-amine is Cc1cc(-c2nc(N)nc(OC(C)C)n2)ccn1.
What is the InChIKey of 4-(2-methyl-4-pyridinyl)-6-propan-2-yloxy-1,3,5-triazin-2-amine?
The InChIKey is CYDJJBQEYDPIKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N5O/c1-7(2)18-12-16-10(15-11(13)17-12)9-4-5-14-8(3)6-9/h4-7H,1-3H3,(H2,13,15,16,17).
What are the key properties of 4-(2-methyl-4-pyridinyl)-6-propan-2-yloxy-1,3,5-triazin-2-amine?
4-(2-methyl-4-pyridinyl)-6-propan-2-yloxy-1,3,5-triazin-2-amine has a molecular weight of 245.29 g/mol, XLogP of 1.61, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methyl-4-pyridinyl)-6-propan-2-yloxy-1,3,5-triazin-2-amine is sourced from PubChem (CID 113482951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).