N-methyl-5-(4-methylphenyl)imidazo[1,2-d][1,2,4]triazin-8-amine

C13H13N5 — CID 177182562

IUPACN-methyl-5-(4-methylphenyl)imidazo[1,2-d][1,2,4]triazin-8-amine
SMILESCNc1nnc(-c2ccc(C)cc2)n2ccnc12
InChIInChI=1S/C13H13N5/c1-9-3-5-10(6-4-9)12-17-16-11(14-2)13-15-7-8-18(12)13/h3-8H,1-2H3,(H,14,16)
InChIKeySAQSQRIAMZOFFV-UHFFFAOYSA-N
MW239.28 g/mol
LogP2.14
Rot. Bonds2

About N-methyl-5-(4-methylphenyl)imidazo[1,2-d][1,2,4]triazin-8-amine

N-methyl-5-(4-methylphenyl)imidazo[1,2-d][1,2,4]triazin-8-amine (PubChem CID 177182562) has the molecular formula C13H13N5 and a molecular weight of 239.28 g/mol. Its IUPAC name is N-methyl-5-(4-methylphenyl)imidazo[1,2-d][1,2,4]triazin-8-amine.

Molecular Properties

Compound NameN-methyl-5-(4-methylphenyl)imidazo[1,2-d][1,2,4]triazin-8-amine
PubChem CID177182562
Molecular FormulaC13H13N5
Molecular Weight239.28 g/mol
Exact Mass239.12
IUPAC NameN-methyl-5-(4-methylphenyl)imidazo[1,2-d][1,2,4]triazin-8-amine
SMILESCNc1nnc(-c2ccc(C)cc2)n2ccnc12
InChIInChI=1S/C13H13N5/c1-9-3-5-10(6-4-9)12-17-16-11(14-2)13-15-7-8-18(12)13/h3-8H,1-2H3,(H,14,16)
InChIKeySAQSQRIAMZOFFV-UHFFFAOYSA-N
XLogP2.14
TPSA55.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-[2-methoxy-4-(trifluoromethyl)phenyl]-N-methylimidazo[1,2-d][1,2,4]triazin-8-amine
CID 177182499
5-methyl-2-(8-methylimidazo[1,2-d][1,2,4]triazin-5-yl)phenol
CID 177182496
5-[8-(methylamino)imidazo[1,2-a]pyrazin-5-yl]-2,3-dihydroinden-1-one
CID 59496149
N-methyl-2-[2-(4-methylphenyl)imidazol-1-yl]ethanamine
CID 82558989
N-methyl-6-(4-methylphenyl)-1,2,4-triazin-5-amine
CID 116823117
5-chloro-2-[8-(hexan-3-ylamino)imidazo[1,2-d][1,2,4]triazin-5-yl]phenol
CID 177182551
4-(8-chloro-[1,2,4]triazolo[4,3-a]pyrazin-3-yl)-1-methylpyridin-2-one
CID 114039746
3-phenyl-8-(2-phenylethynyl)-[1,2,4]triazolo[4,3-a]pyrazine
CID 135026654
3-(3-fluoro-4-methoxyphenyl)-N-methylimidazo[1,2-a]pyrazin-8-amine
CID 58777802
3-N-methyl-8-N-(2-methylphenyl)-[1,2,4]triazolo[4,3-a]pyrazine-3,8-diamine
CID 58328691
7,10-dimethylimidazo[1,2-f]phenanthridine
CID 58943988
ethane;5-(4-methylphenyl)imidazo[1,2-a]pyridine
CID 142047032

Frequently Asked Questions

What is the IUPAC name of N-methyl-5-(4-methylphenyl)imidazo[1,2-d][1,2,4]triazin-8-amine?
The IUPAC name of N-methyl-5-(4-methylphenyl)imidazo[1,2-d][1,2,4]triazin-8-amine (CID 177182562) is N-methyl-5-(4-methylphenyl)imidazo[1,2-d][1,2,4]triazin-8-amine.
What is the SMILES notation for N-methyl-5-(4-methylphenyl)imidazo[1,2-d][1,2,4]triazin-8-amine?
The canonical SMILES for N-methyl-5-(4-methylphenyl)imidazo[1,2-d][1,2,4]triazin-8-amine is CNc1nnc(-c2ccc(C)cc2)n2ccnc12.
What is the InChIKey of N-methyl-5-(4-methylphenyl)imidazo[1,2-d][1,2,4]triazin-8-amine?
The InChIKey is SAQSQRIAMZOFFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N5/c1-9-3-5-10(6-4-9)12-17-16-11(14-2)13-15-7-8-18(12)13/h3-8H,1-2H3,(H,14,16).
What are the key properties of N-methyl-5-(4-methylphenyl)imidazo[1,2-d][1,2,4]triazin-8-amine?
N-methyl-5-(4-methylphenyl)imidazo[1,2-d][1,2,4]triazin-8-amine has a molecular weight of 239.28 g/mol, XLogP of 2.14, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-(4-methylphenyl)imidazo[1,2-d][1,2,4]triazin-8-amine is sourced from PubChem (CID 177182562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).