[(1R,2S)-2-[(5-ethylpyrazolo[1,5-a]pyrimidin-7-yl)amino]cyclopentyl]methanol

C14H20N4O — CID 56914472

IUPAC[(1R,2S)-2-[(5-ethylpyrazolo[1,5-a]pyrimidin-7-yl)amino]cyclopentyl]methanol
SMILESCCc1cc(N[C@H]2CCC[C@H]2CO)n2nccc2n1
InChIInChI=1S/C14H20N4O/c1-2-11-8-14(18-13(16-11)6-7-15-18)17-12-5-3-4-10(12)9-19/h6-8,10,12,17,19H,2-5,9H2,1H3/t10-,12-/m0/s1
InChIKeyQLTZRTWDSZZZEI-JQWIXIFHSA-N
MW260.34 g/mol
LogP1.86
Rot. Bonds4

About [(1R,2S)-2-[(5-ethylpyrazolo[1,5-a]pyrimidin-7-yl)amino]cyclopentyl]methanol

[(1R,2S)-2-[(5-ethylpyrazolo[1,5-a]pyrimidin-7-yl)amino]cyclopentyl]methanol (PubChem CID 56914472) has the molecular formula C14H20N4O and a molecular weight of 260.34 g/mol. Its IUPAC name is [(1R,2S)-2-[(5-ethylpyrazolo[1,5-a]pyrimidin-7-yl)amino]cyclopentyl]methanol.

Molecular Properties

Compound Name[(1R,2S)-2-[(5-ethylpyrazolo[1,5-a]pyrimidin-7-yl)amino]cyclopentyl]methanol
PubChem CID56914472
Molecular FormulaC14H20N4O
Molecular Weight260.34 g/mol
Exact Mass260.16
IUPAC Name[(1R,2S)-2-[(5-ethylpyrazolo[1,5-a]pyrimidin-7-yl)amino]cyclopentyl]methanol
SMILESCCc1cc(N[C@H]2CCC[C@H]2CO)n2nccc2n1
InChIInChI=1S/C14H20N4O/c1-2-11-8-14(18-13(16-11)6-7-15-18)17-12-5-3-4-10(12)9-19/h6-8,10,12,17,19H,2-5,9H2,1H3/t10-,12-/m0/s1
InChIKeyQLTZRTWDSZZZEI-JQWIXIFHSA-N
XLogP1.86
TPSA62.45 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [(1R,2S)-2-[(5-ethylpyrazolo[1,5-a]pyrimidin-7-yl)amino]cyclopentyl]methanol?
The IUPAC name of [(1R,2S)-2-[(5-ethylpyrazolo[1,5-a]pyrimidin-7-yl)amino]cyclopentyl]methanol (CID 56914472) is [(1R,2S)-2-[(5-ethylpyrazolo[1,5-a]pyrimidin-7-yl)amino]cyclopentyl]methanol.
What is the SMILES notation for [(1R,2S)-2-[(5-ethylpyrazolo[1,5-a]pyrimidin-7-yl)amino]cyclopentyl]methanol?
The canonical SMILES for [(1R,2S)-2-[(5-ethylpyrazolo[1,5-a]pyrimidin-7-yl)amino]cyclopentyl]methanol is CCc1cc(N[C@H]2CCC[C@H]2CO)n2nccc2n1.
What is the InChIKey of [(1R,2S)-2-[(5-ethylpyrazolo[1,5-a]pyrimidin-7-yl)amino]cyclopentyl]methanol?
The InChIKey is QLTZRTWDSZZZEI-JQWIXIFHSA-N. The full InChI is InChI=1S/C14H20N4O/c1-2-11-8-14(18-13(16-11)6-7-15-18)17-12-5-3-4-10(12)9-19/h6-8,10,12,17,19H,2-5,9H2,1H3/t10-,12-/m0/s1.
What are the key properties of [(1R,2S)-2-[(5-ethylpyrazolo[1,5-a]pyrimidin-7-yl)amino]cyclopentyl]methanol?
[(1R,2S)-2-[(5-ethylpyrazolo[1,5-a]pyrimidin-7-yl)amino]cyclopentyl]methanol has a molecular weight of 260.34 g/mol, XLogP of 1.86, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R,2S)-2-[(5-ethylpyrazolo[1,5-a]pyrimidin-7-yl)amino]cyclopentyl]methanol is sourced from PubChem (CID 56914472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).