5-[(3R)-3-aminopiperidin-1-yl]-N-(1H-pyrazol-5-yl)pyrazolo[1,5-a]pyrimidin-7-amine

C14H18N8 — CID 162664794

IUPAC5-[(3R)-3-aminopiperidin-1-yl]-N-(1H-pyrazol-5-yl)pyrazolo[1,5-a]pyrimidin-7-amine
SMILESN[C@@H]1CCCN(c2cc(Nc3ccn[nH]3)n3nccc3n2)C1
InChIInChI=1S/C14H18N8/c15-10-2-1-7-21(9-10)13-8-14(18-11-3-5-16-20-11)22-12(19-13)4-6-17-22/h3-6,8,10H,1-2,7,9,15H2,(H2,16,18,20)/t10-/m1/s1
InChIKeyAGXRHXCOACBRFK-SNVBAGLBSA-N
MW298.35 g/mol
LogP1.12
Rot. Bonds3

About 5-[(3R)-3-aminopiperidin-1-yl]-N-(1H-pyrazol-5-yl)pyrazolo[1,5-a]pyrimidin-7-amine

5-[(3R)-3-aminopiperidin-1-yl]-N-(1H-pyrazol-5-yl)pyrazolo[1,5-a]pyrimidin-7-amine (PubChem CID 162664794) has the molecular formula C14H18N8 and a molecular weight of 298.35 g/mol. Its IUPAC name is 5-[(3R)-3-aminopiperidin-1-yl]-N-(1H-pyrazol-5-yl)pyrazolo[1,5-a]pyrimidin-7-amine.

Molecular Properties

Compound Name5-[(3R)-3-aminopiperidin-1-yl]-N-(1H-pyrazol-5-yl)pyrazolo[1,5-a]pyrimidin-7-amine
PubChem CID162664794
Molecular FormulaC14H18N8
Molecular Weight298.35 g/mol
Exact Mass298.17
IUPAC Name5-[(3R)-3-aminopiperidin-1-yl]-N-(1H-pyrazol-5-yl)pyrazolo[1,5-a]pyrimidin-7-amine
SMILESN[C@@H]1CCCN(c2cc(Nc3ccn[nH]3)n3nccc3n2)C1
InChIInChI=1S/C14H18N8/c15-10-2-1-7-21(9-10)13-8-14(18-11-3-5-16-20-11)22-12(19-13)4-6-17-22/h3-6,8,10H,1-2,7,9,15H2,(H2,16,18,20)/t10-/m1/s1
InChIKeyAGXRHXCOACBRFK-SNVBAGLBSA-N
XLogP1.12
TPSA100.16 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.35
LogP ≤ 51.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 5-[(3R)-3-aminopiperidin-1-yl]-N-(1H-pyrazol-5-yl)pyrazolo[1,5-a]pyrimidin-7-amine?
The IUPAC name of 5-[(3R)-3-aminopiperidin-1-yl]-N-(1H-pyrazol-5-yl)pyrazolo[1,5-a]pyrimidin-7-amine (CID 162664794) is 5-[(3R)-3-aminopiperidin-1-yl]-N-(1H-pyrazol-5-yl)pyrazolo[1,5-a]pyrimidin-7-amine.
What is the SMILES notation for 5-[(3R)-3-aminopiperidin-1-yl]-N-(1H-pyrazol-5-yl)pyrazolo[1,5-a]pyrimidin-7-amine?
The canonical SMILES for 5-[(3R)-3-aminopiperidin-1-yl]-N-(1H-pyrazol-5-yl)pyrazolo[1,5-a]pyrimidin-7-amine is N[C@@H]1CCCN(c2cc(Nc3ccn[nH]3)n3nccc3n2)C1.
What is the InChIKey of 5-[(3R)-3-aminopiperidin-1-yl]-N-(1H-pyrazol-5-yl)pyrazolo[1,5-a]pyrimidin-7-amine?
The InChIKey is AGXRHXCOACBRFK-SNVBAGLBSA-N. The full InChI is InChI=1S/C14H18N8/c15-10-2-1-7-21(9-10)13-8-14(18-11-3-5-16-20-11)22-12(19-13)4-6-17-22/h3-6,8,10H,1-2,7,9,15H2,(H2,16,18,20)/t10-/m1/s1.
What are the key properties of 5-[(3R)-3-aminopiperidin-1-yl]-N-(1H-pyrazol-5-yl)pyrazolo[1,5-a]pyrimidin-7-amine?
5-[(3R)-3-aminopiperidin-1-yl]-N-(1H-pyrazol-5-yl)pyrazolo[1,5-a]pyrimidin-7-amine has a molecular weight of 298.35 g/mol, XLogP of 1.12, 3 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(3R)-3-aminopiperidin-1-yl]-N-(1H-pyrazol-5-yl)pyrazolo[1,5-a]pyrimidin-7-amine is sourced from PubChem (CID 162664794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).