[1-(4-amino-1,3-dimethylpyrazol-5-yl)piperidin-4-yl]methanol

C11H20N4O — CID 43554217

IUPAC[1-(4-amino-1,3-dimethylpyrazol-5-yl)piperidin-4-yl]methanol
SMILESCc1nn(C)c(N2CCC(CO)CC2)c1N
InChIInChI=1S/C11H20N4O/c1-8-10(12)11(14(2)13-8)15-5-3-9(7-16)4-6-15/h9,16H,3-7,12H2,1-2H3
InChIKeyXSBDHDCLTSLVQG-UHFFFAOYSA-N
MW224.31 g/mol
LogP0.52
Rot. Bonds2

About [1-(4-amino-1,3-dimethylpyrazol-5-yl)piperidin-4-yl]methanol

[1-(4-amino-1,3-dimethylpyrazol-5-yl)piperidin-4-yl]methanol (PubChem CID 43554217) has the molecular formula C11H20N4O and a molecular weight of 224.31 g/mol. Its IUPAC name is [1-(4-amino-1,3-dimethylpyrazol-5-yl)piperidin-4-yl]methanol.

Molecular Properties

Compound Name[1-(4-amino-1,3-dimethylpyrazol-5-yl)piperidin-4-yl]methanol
PubChem CID43554217
Molecular FormulaC11H20N4O
Molecular Weight224.31 g/mol
Exact Mass224.16
IUPAC Name[1-(4-amino-1,3-dimethylpyrazol-5-yl)piperidin-4-yl]methanol
SMILESCc1nn(C)c(N2CCC(CO)CC2)c1N
InChIInChI=1S/C11H20N4O/c1-8-10(12)11(14(2)13-8)15-5-3-9(7-16)4-6-15/h9,16H,3-7,12H2,1-2H3
InChIKeyXSBDHDCLTSLVQG-UHFFFAOYSA-N
XLogP0.52
TPSA67.31 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.31
LogP ≤ 50.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [1-(4-amino-1,3-dimethylpyrazol-5-yl)piperidin-4-yl]methanol?
The IUPAC name of [1-(4-amino-1,3-dimethylpyrazol-5-yl)piperidin-4-yl]methanol (CID 43554217) is [1-(4-amino-1,3-dimethylpyrazol-5-yl)piperidin-4-yl]methanol.
What is the SMILES notation for [1-(4-amino-1,3-dimethylpyrazol-5-yl)piperidin-4-yl]methanol?
The canonical SMILES for [1-(4-amino-1,3-dimethylpyrazol-5-yl)piperidin-4-yl]methanol is Cc1nn(C)c(N2CCC(CO)CC2)c1N.
What is the InChIKey of [1-(4-amino-1,3-dimethylpyrazol-5-yl)piperidin-4-yl]methanol?
The InChIKey is XSBDHDCLTSLVQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O/c1-8-10(12)11(14(2)13-8)15-5-3-9(7-16)4-6-15/h9,16H,3-7,12H2,1-2H3.
What are the key properties of [1-(4-amino-1,3-dimethylpyrazol-5-yl)piperidin-4-yl]methanol?
[1-(4-amino-1,3-dimethylpyrazol-5-yl)piperidin-4-yl]methanol has a molecular weight of 224.31 g/mol, XLogP of 0.52, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-amino-1,3-dimethylpyrazol-5-yl)piperidin-4-yl]methanol is sourced from PubChem (CID 43554217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).