N-(2,5-dimethylphenyl)-3-morpholin-4-yl-1,2,4-triazin-5-amine

C15H19N5O — CID 30298428

IUPACN-(2,5-dimethylphenyl)-3-morpholin-4-yl-1,2,4-triazin-5-amine
SMILESCc1ccc(C)c(Nc2cnnc(N3CCOCC3)n2)c1
InChIInChI=1S/C15H19N5O/c1-11-3-4-12(2)13(9-11)17-14-10-16-19-15(18-14)20-5-7-21-8-6-20/h3-4,9-10H,5-8H2,1-2H3,(H,17,18,19)
InChIKeyVBRZOSWBSITPCU-UHFFFAOYSA-N
MW285.35 g/mol
LogP2.07
Rot. Bonds3

About N-(2,5-dimethylphenyl)-3-morpholin-4-yl-1,2,4-triazin-5-amine

N-(2,5-dimethylphenyl)-3-morpholin-4-yl-1,2,4-triazin-5-amine (PubChem CID 30298428) has the molecular formula C15H19N5O and a molecular weight of 285.35 g/mol. Its IUPAC name is N-(2,5-dimethylphenyl)-3-morpholin-4-yl-1,2,4-triazin-5-amine.

Molecular Properties

Compound NameN-(2,5-dimethylphenyl)-3-morpholin-4-yl-1,2,4-triazin-5-amine
PubChem CID30298428
Molecular FormulaC15H19N5O
Molecular Weight285.35 g/mol
Exact Mass285.16
IUPAC NameN-(2,5-dimethylphenyl)-3-morpholin-4-yl-1,2,4-triazin-5-amine
SMILESCc1ccc(C)c(Nc2cnnc(N3CCOCC3)n2)c1
InChIInChI=1S/C15H19N5O/c1-11-3-4-12(2)13(9-11)17-14-10-16-19-15(18-14)20-5-7-21-8-6-20/h3-4,9-10H,5-8H2,1-2H3,(H,17,18,19)
InChIKeyVBRZOSWBSITPCU-UHFFFAOYSA-N
XLogP2.07
TPSA63.17 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2,5-dimethylphenyl)-3-(4-phenylpiperazin-1-yl)-1,2,4-triazin-5-amine
CID 112955547
N-(2,5-dimethylphenyl)-3-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-1,2,4-triazin-5-amine
CID 112956607
N-(2-fluorophenyl)-3-morpholin-4-yl-1,2,4-triazin-5-amine
CID 30298452
N-(5-chloro-2-methylphenyl)-3-(4-methylpiperazin-1-yl)-1,2,4-triazin-5-amine
CID 112946051
3-(2,3-dihydroindol-1-yl)-N-(2,5-dimethylphenyl)-1,2,4-triazin-5-amine
CID 112962664
4-chloro-N-(2,5-dimethylphenyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 3732346
N-(4-tert-butylphenyl)-3-morpholin-4-yl-1,2,4-triazin-5-amine
CID 112944290
5-N-(2,5-dimethylphenyl)-3-N-(4-pyrrolidin-1-ylphenyl)-1,2,4-triazine-3,5-diamine
CID 112963176
3-(3,4-dihydro-2H-quinolin-1-yl)-N-(2,5-dimethylphenyl)-1,2,4-triazin-5-amine
CID 112962856
2-N-(2,5-dimethylphenyl)-6-morpholin-4-yl-4-N-phenyl-1,3,5-triazine-2,4-diamine
CID 39847761
N-(5-chloro-2-methylphenyl)-6-methyl-2-morpholin-4-ylpyrimidin-4-amine
CID 112912329
N-(2,4-dimethylphenyl)-3-(4-pyridin-2-ylpiperazin-1-yl)-1,2,4-triazin-5-amine
CID 112957955

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethylphenyl)-3-morpholin-4-yl-1,2,4-triazin-5-amine?
The IUPAC name of N-(2,5-dimethylphenyl)-3-morpholin-4-yl-1,2,4-triazin-5-amine (CID 30298428) is N-(2,5-dimethylphenyl)-3-morpholin-4-yl-1,2,4-triazin-5-amine.
What is the SMILES notation for N-(2,5-dimethylphenyl)-3-morpholin-4-yl-1,2,4-triazin-5-amine?
The canonical SMILES for N-(2,5-dimethylphenyl)-3-morpholin-4-yl-1,2,4-triazin-5-amine is Cc1ccc(C)c(Nc2cnnc(N3CCOCC3)n2)c1.
What is the InChIKey of N-(2,5-dimethylphenyl)-3-morpholin-4-yl-1,2,4-triazin-5-amine?
The InChIKey is VBRZOSWBSITPCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5O/c1-11-3-4-12(2)13(9-11)17-14-10-16-19-15(18-14)20-5-7-21-8-6-20/h3-4,9-10H,5-8H2,1-2H3,(H,17,18,19).
What are the key properties of N-(2,5-dimethylphenyl)-3-morpholin-4-yl-1,2,4-triazin-5-amine?
N-(2,5-dimethylphenyl)-3-morpholin-4-yl-1,2,4-triazin-5-amine has a molecular weight of 285.35 g/mol, XLogP of 2.07, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethylphenyl)-3-morpholin-4-yl-1,2,4-triazin-5-amine is sourced from PubChem (CID 30298428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).