N-(5-methyl-1H-pyrazol-3-yl)pyrrolo[1,2-a][1,3,5]triazin-4-amine

C10H10N6 — CID 173089526

IUPACN-(5-methyl-1H-pyrazol-3-yl)pyrrolo[1,2-a][1,3,5]triazin-4-amine
SMILESCc1cc(Nc2ncnc3cccn23)n[nH]1
InChIInChI=1S/C10H10N6/c1-7-5-8(15-14-7)13-10-12-6-11-9-3-2-4-16(9)10/h2-6H,1H3,(H2,11,12,13,14,15)
InChIKeyUNWJRDVJAZDPDE-UHFFFAOYSA-N
MW214.23 g/mol
LogP1.50
Rot. Bonds2

About N-(5-methyl-1H-pyrazol-3-yl)pyrrolo[1,2-a][1,3,5]triazin-4-amine

N-(5-methyl-1H-pyrazol-3-yl)pyrrolo[1,2-a][1,3,5]triazin-4-amine (PubChem CID 173089526) has the molecular formula C10H10N6 and a molecular weight of 214.23 g/mol. Its IUPAC name is N-(5-methyl-1H-pyrazol-3-yl)pyrrolo[1,2-a][1,3,5]triazin-4-amine.

Molecular Properties

Compound NameN-(5-methyl-1H-pyrazol-3-yl)pyrrolo[1,2-a][1,3,5]triazin-4-amine
PubChem CID173089526
Molecular FormulaC10H10N6
Molecular Weight214.23 g/mol
Exact Mass214.10
IUPAC NameN-(5-methyl-1H-pyrazol-3-yl)pyrrolo[1,2-a][1,3,5]triazin-4-amine
SMILESCc1cc(Nc2ncnc3cccn23)n[nH]1
InChIInChI=1S/C10H10N6/c1-7-5-8(15-14-7)13-10-12-6-11-9-3-2-4-16(9)10/h2-6H,1H3,(H2,11,12,13,14,15)
InChIKeyUNWJRDVJAZDPDE-UHFFFAOYSA-N
XLogP1.50
TPSA70.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.23
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

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CID 52104010
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Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-1H-pyrazol-3-yl)pyrrolo[1,2-a][1,3,5]triazin-4-amine?
The IUPAC name of N-(5-methyl-1H-pyrazol-3-yl)pyrrolo[1,2-a][1,3,5]triazin-4-amine (CID 173089526) is N-(5-methyl-1H-pyrazol-3-yl)pyrrolo[1,2-a][1,3,5]triazin-4-amine.
What is the SMILES notation for N-(5-methyl-1H-pyrazol-3-yl)pyrrolo[1,2-a][1,3,5]triazin-4-amine?
The canonical SMILES for N-(5-methyl-1H-pyrazol-3-yl)pyrrolo[1,2-a][1,3,5]triazin-4-amine is Cc1cc(Nc2ncnc3cccn23)n[nH]1.
What is the InChIKey of N-(5-methyl-1H-pyrazol-3-yl)pyrrolo[1,2-a][1,3,5]triazin-4-amine?
The InChIKey is UNWJRDVJAZDPDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N6/c1-7-5-8(15-14-7)13-10-12-6-11-9-3-2-4-16(9)10/h2-6H,1H3,(H2,11,12,13,14,15).
What are the key properties of N-(5-methyl-1H-pyrazol-3-yl)pyrrolo[1,2-a][1,3,5]triazin-4-amine?
N-(5-methyl-1H-pyrazol-3-yl)pyrrolo[1,2-a][1,3,5]triazin-4-amine has a molecular weight of 214.23 g/mol, XLogP of 1.50, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-1H-pyrazol-3-yl)pyrrolo[1,2-a][1,3,5]triazin-4-amine is sourced from PubChem (CID 173089526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).