5-(2-methylpropyl)-1,2,4-triazin-3-amine

C7H12N4 — CID 105429780

IUPAC5-(2-methylpropyl)-1,2,4-triazin-3-amine
SMILESCC(C)Cc1cnnc(N)n1
InChIInChI=1S/C7H12N4/c1-5(2)3-6-4-9-11-7(8)10-6/h4-5H,3H2,1-2H3,(H2,8,10,11)
InChIKeyKOUOYJGZHBYDMH-UHFFFAOYSA-N
MW152.20 g/mol
LogP0.65
Rot. Bonds2

About 5-(2-methylpropyl)-1,2,4-triazin-3-amine

5-(2-methylpropyl)-1,2,4-triazin-3-amine (PubChem CID 105429780) has the molecular formula C7H12N4 and a molecular weight of 152.20 g/mol. Its IUPAC name is 5-(2-methylpropyl)-1,2,4-triazin-3-amine.

Molecular Properties

Compound Name5-(2-methylpropyl)-1,2,4-triazin-3-amine
PubChem CID105429780
Molecular FormulaC7H12N4
Molecular Weight152.20 g/mol
Exact Mass152.11
IUPAC Name5-(2-methylpropyl)-1,2,4-triazin-3-amine
SMILESCC(C)Cc1cnnc(N)n1
InChIInChI=1S/C7H12N4/c1-5(2)3-6-4-9-11-7(8)10-6/h4-5H,3H2,1-2H3,(H2,8,10,11)
InChIKeyKOUOYJGZHBYDMH-UHFFFAOYSA-N
XLogP0.65
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.20
LogP ≤ 50.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[5-(2-methylpropyl)-1,2,4-triazin-3-yl]acetic acid
CID 105448907
2,3-dimethyl-5-(2-methylpropyl)pyrazine
CID 528108
ethane;4-(2-methylpropyl)-1,3-thiazol-2-amine
CID 142312130
5-(2-methylpropyl)-2H-1,2,4-triazin-3-one
CID 105429895
1-(5-ethyl-1,2,4-triazin-3-yl)ethanamine
CID 105429787
5-(2-fluoropropan-2-yl)-1,2,4-triazin-3-amine
CID 22240088
6,7-dichloro-2-(2-methylpropyl)quinoxaline
CID 141430619
3-amino-6-(2-methylpropyl)thieno[2,3-b]pyridine-2-carboxamide
CID 949210
[6-(2-methylpropyl)-3-pyridinyl]methanamine
CID 53274665
1-hydroxy-2-methyl-4-(2-methylpropyl)imidazole
CID 86155423
4-(2,3-dichlorophenyl)-6-(2-methylpropyl)pyrimidin-2-amine
CID 158757005
4-amino-6-(2-methylpropyl)pyrimidine-2-carbonitrile
CID 131616898

Frequently Asked Questions

What is the IUPAC name of 5-(2-methylpropyl)-1,2,4-triazin-3-amine?
The IUPAC name of 5-(2-methylpropyl)-1,2,4-triazin-3-amine (CID 105429780) is 5-(2-methylpropyl)-1,2,4-triazin-3-amine.
What is the SMILES notation for 5-(2-methylpropyl)-1,2,4-triazin-3-amine?
The canonical SMILES for 5-(2-methylpropyl)-1,2,4-triazin-3-amine is CC(C)Cc1cnnc(N)n1.
What is the InChIKey of 5-(2-methylpropyl)-1,2,4-triazin-3-amine?
The InChIKey is KOUOYJGZHBYDMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N4/c1-5(2)3-6-4-9-11-7(8)10-6/h4-5H,3H2,1-2H3,(H2,8,10,11).
What are the key properties of 5-(2-methylpropyl)-1,2,4-triazin-3-amine?
5-(2-methylpropyl)-1,2,4-triazin-3-amine has a molecular weight of 152.20 g/mol, XLogP of 0.65, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methylpropyl)-1,2,4-triazin-3-amine is sourced from PubChem (CID 105429780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).