[1-[[4-(methylamino)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]amino]cyclopentyl]methanol

C13H19N7O — CID 80802661

IUPAC[1-[[4-(methylamino)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]amino]cyclopentyl]methanol
SMILESCNc1nc(NC2(CO)CCCC2)nc(-n2cccn2)n1
InChIInChI=1S/C13H19N7O/c1-14-10-16-11(19-13(9-21)5-2-3-6-13)18-12(17-10)20-8-4-7-15-20/h4,7-8,21H,2-3,5-6,9H2,1H3,(H2,14,16,17,18,19)
InChIKeySRFLLZPCXQITCT-UHFFFAOYSA-N
MW289.34 g/mol
LogP0.82
Rot. Bonds5

About [1-[[4-(methylamino)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]amino]cyclopentyl]methanol

[1-[[4-(methylamino)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]amino]cyclopentyl]methanol (PubChem CID 80802661) has the molecular formula C13H19N7O and a molecular weight of 289.34 g/mol. Its IUPAC name is [1-[[4-(methylamino)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]amino]cyclopentyl]methanol.

Molecular Properties

Compound Name[1-[[4-(methylamino)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]amino]cyclopentyl]methanol
PubChem CID80802661
Molecular FormulaC13H19N7O
Molecular Weight289.34 g/mol
Exact Mass289.17
IUPAC Name[1-[[4-(methylamino)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]amino]cyclopentyl]methanol
SMILESCNc1nc(NC2(CO)CCCC2)nc(-n2cccn2)n1
InChIInChI=1S/C13H19N7O/c1-14-10-16-11(19-13(9-21)5-2-3-6-13)18-12(17-10)20-8-4-7-15-20/h4,7-8,21H,2-3,5-6,9H2,1H3,(H2,14,16,17,18,19)
InChIKeySRFLLZPCXQITCT-UHFFFAOYSA-N
XLogP0.82
TPSA100.78 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.34
LogP ≤ 50.82
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

Analyze [1-[[4-(methylamino)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]amino]cyclopentyl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [1-[[4-(methylamino)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]amino]cyclopentyl]methanol?
The IUPAC name of [1-[[4-(methylamino)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]amino]cyclopentyl]methanol (CID 80802661) is [1-[[4-(methylamino)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]amino]cyclopentyl]methanol.
What is the SMILES notation for [1-[[4-(methylamino)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]amino]cyclopentyl]methanol?
The canonical SMILES for [1-[[4-(methylamino)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]amino]cyclopentyl]methanol is CNc1nc(NC2(CO)CCCC2)nc(-n2cccn2)n1.
What is the InChIKey of [1-[[4-(methylamino)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]amino]cyclopentyl]methanol?
The InChIKey is SRFLLZPCXQITCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N7O/c1-14-10-16-11(19-13(9-21)5-2-3-6-13)18-12(17-10)20-8-4-7-15-20/h4,7-8,21H,2-3,5-6,9H2,1H3,(H2,14,16,17,18,19).
What are the key properties of [1-[[4-(methylamino)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]amino]cyclopentyl]methanol?
[1-[[4-(methylamino)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]amino]cyclopentyl]methanol has a molecular weight of 289.34 g/mol, XLogP of 0.82, 5 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[[4-(methylamino)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]amino]cyclopentyl]methanol is sourced from PubChem (CID 80802661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).