8-propan-2-yl-1,4-dihydropyrazolo[1,5-a][1,3,5]triazine-2,4-diamine

C8H14N6 — CID 137132194

IUPAC8-propan-2-yl-1,4-dihydropyrazolo[1,5-a][1,3,5]triazine-2,4-diamine
SMILESCC(C)c1cnn2c1NC(N)=NC2N
InChIInChI=1S/C8H14N6/c1-4(2)5-3-11-14-6(5)12-7(9)13-8(14)10/h3-4,8H,10H2,1-2H3,(H3,9,12,13)
InChIKeyGSJSFAWDHIEWPM-UHFFFAOYSA-N
MW194.24 g/mol
LogP0.16
Rot. Bonds1

About 8-propan-2-yl-1,4-dihydropyrazolo[1,5-a][1,3,5]triazine-2,4-diamine

8-propan-2-yl-1,4-dihydropyrazolo[1,5-a][1,3,5]triazine-2,4-diamine (PubChem CID 137132194) has the molecular formula C8H14N6 and a molecular weight of 194.24 g/mol. Its IUPAC name is 8-propan-2-yl-1,4-dihydropyrazolo[1,5-a][1,3,5]triazine-2,4-diamine.

Molecular Properties

Compound Name8-propan-2-yl-1,4-dihydropyrazolo[1,5-a][1,3,5]triazine-2,4-diamine
PubChem CID137132194
Molecular FormulaC8H14N6
Molecular Weight194.24 g/mol
Exact Mass194.13
IUPAC Name8-propan-2-yl-1,4-dihydropyrazolo[1,5-a][1,3,5]triazine-2,4-diamine
SMILESCC(C)c1cnn2c1NC(N)=NC2N
InChIInChI=1S/C8H14N6/c1-4(2)5-3-11-14-6(5)12-7(9)13-8(14)10/h3-4,8H,10H2,1-2H3,(H3,9,12,13)
InChIKeyGSJSFAWDHIEWPM-UHFFFAOYSA-N
XLogP0.16
TPSA94.25 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.24
LogP ≤ 50.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

4-isopropyl-1-methyl-1H-pyrazol-5-amine
CID 20823874
4-ethyl-1-isopropyl-1H-pyrazol-5-amine
CID 126480383
3-cyclopropyl-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine
CID 136307804
3-Propan-2-yl-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine
CID 153470373
1-(2-fluoroethyl)-4-methyl-N-(3-methylbutyl)-1H-pyrazol-5-amine
CID 122168910
7-(Difluoromethyl)-3-ethyl-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine
CID 136841167
3-ethyl-5-methyl-7-(trifluoromethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine
CID 136841183
3-ethyl-7-(trifluoromethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine
CID 136841204
7-(difluoromethyl)-3-ethyl-5-methyl-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine
CID 165475487
4-Isopropyl-1H-pyrazole-1-carboximidamide
CID 12356166
4-(2-Aminoethyl)-1-methyl-1H-pyrazol-5-amine dihydrochloride
CID 17961976
4-(2-Aminoethyl)-1-methyl-1H-pyrazol-5-amine
CID 17961977

Frequently Asked Questions

What is the IUPAC name of 8-propan-2-yl-1,4-dihydropyrazolo[1,5-a][1,3,5]triazine-2,4-diamine?
The IUPAC name of 8-propan-2-yl-1,4-dihydropyrazolo[1,5-a][1,3,5]triazine-2,4-diamine (CID 137132194) is 8-propan-2-yl-1,4-dihydropyrazolo[1,5-a][1,3,5]triazine-2,4-diamine.
What is the SMILES notation for 8-propan-2-yl-1,4-dihydropyrazolo[1,5-a][1,3,5]triazine-2,4-diamine?
The canonical SMILES for 8-propan-2-yl-1,4-dihydropyrazolo[1,5-a][1,3,5]triazine-2,4-diamine is CC(C)c1cnn2c1NC(N)=NC2N.
What is the InChIKey of 8-propan-2-yl-1,4-dihydropyrazolo[1,5-a][1,3,5]triazine-2,4-diamine?
The InChIKey is GSJSFAWDHIEWPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N6/c1-4(2)5-3-11-14-6(5)12-7(9)13-8(14)10/h3-4,8H,10H2,1-2H3,(H3,9,12,13).
What are the key properties of 8-propan-2-yl-1,4-dihydropyrazolo[1,5-a][1,3,5]triazine-2,4-diamine?
8-propan-2-yl-1,4-dihydropyrazolo[1,5-a][1,3,5]triazine-2,4-diamine has a molecular weight of 194.24 g/mol, XLogP of 0.16, 1 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 8-propan-2-yl-1,4-dihydropyrazolo[1,5-a][1,3,5]triazine-2,4-diamine is sourced from PubChem (CID 137132194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).