1-[1-(2-methoxy-4-pyridinyl)piperidin-4-yl]pyrazol-3-amine

C14H19N5O — CID 107110261

IUPAC1-[1-(2-methoxy-4-pyridinyl)piperidin-4-yl]pyrazol-3-amine
SMILESCOc1cc(N2CCC(n3ccc(N)n3)CC2)ccn1
InChIInChI=1S/C14H19N5O/c1-20-14-10-12(2-6-16-14)18-7-3-11(4-8-18)19-9-5-13(15)17-19/h2,5-6,9-11H,3-4,7-8H2,1H3,(H2,15,17)
InChIKeyUSOFLQAXEQYMKQ-UHFFFAOYSA-N
MW273.34 g/mol
LogP1.71
Rot. Bonds3

About 1-[1-(2-methoxy-4-pyridinyl)piperidin-4-yl]pyrazol-3-amine

1-[1-(2-methoxy-4-pyridinyl)piperidin-4-yl]pyrazol-3-amine (PubChem CID 107110261) has the molecular formula C14H19N5O and a molecular weight of 273.34 g/mol. Its IUPAC name is 1-[1-(2-methoxy-4-pyridinyl)piperidin-4-yl]pyrazol-3-amine.

Molecular Properties

Compound Name1-[1-(2-methoxy-4-pyridinyl)piperidin-4-yl]pyrazol-3-amine
PubChem CID107110261
Molecular FormulaC14H19N5O
Molecular Weight273.34 g/mol
Exact Mass273.16
IUPAC Name1-[1-(2-methoxy-4-pyridinyl)piperidin-4-yl]pyrazol-3-amine
SMILESCOc1cc(N2CCC(n3ccc(N)n3)CC2)ccn1
InChIInChI=1S/C14H19N5O/c1-20-14-10-12(2-6-16-14)18-7-3-11(4-8-18)19-9-5-13(15)17-19/h2,5-6,9-11H,3-4,7-8H2,1H3,(H2,15,17)
InChIKeyUSOFLQAXEQYMKQ-UHFFFAOYSA-N
XLogP1.71
TPSA69.20 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-[1-(2-methoxy-4-pyridinyl)piperidin-4-yl]pyrazol-3-amine?
The IUPAC name of 1-[1-(2-methoxy-4-pyridinyl)piperidin-4-yl]pyrazol-3-amine (CID 107110261) is 1-[1-(2-methoxy-4-pyridinyl)piperidin-4-yl]pyrazol-3-amine.
What is the SMILES notation for 1-[1-(2-methoxy-4-pyridinyl)piperidin-4-yl]pyrazol-3-amine?
The canonical SMILES for 1-[1-(2-methoxy-4-pyridinyl)piperidin-4-yl]pyrazol-3-amine is COc1cc(N2CCC(n3ccc(N)n3)CC2)ccn1.
What is the InChIKey of 1-[1-(2-methoxy-4-pyridinyl)piperidin-4-yl]pyrazol-3-amine?
The InChIKey is USOFLQAXEQYMKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5O/c1-20-14-10-12(2-6-16-14)18-7-3-11(4-8-18)19-9-5-13(15)17-19/h2,5-6,9-11H,3-4,7-8H2,1H3,(H2,15,17).
What are the key properties of 1-[1-(2-methoxy-4-pyridinyl)piperidin-4-yl]pyrazol-3-amine?
1-[1-(2-methoxy-4-pyridinyl)piperidin-4-yl]pyrazol-3-amine has a molecular weight of 273.34 g/mol, XLogP of 1.71, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(2-methoxy-4-pyridinyl)piperidin-4-yl]pyrazol-3-amine is sourced from PubChem (CID 107110261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).