5-(4-methylpiperidin-3-yl)oxypyrazolo[1,5-a]pyrimidine

C12H16N4O — CID 102954631

IUPAC5-(4-methylpiperidin-3-yl)oxypyrazolo[1,5-a]pyrimidine
SMILESCC1CCNCC1Oc1ccn2nccc2n1
InChIInChI=1S/C12H16N4O/c1-9-2-5-13-8-10(9)17-12-4-7-16-11(15-12)3-6-14-16/h3-4,6-7,9-10,13H,2,5,8H2,1H3
InChIKeyOJEOLBAPMDKJNF-UHFFFAOYSA-N
MW232.29 g/mol
LogP1.11
Rot. Bonds2

About 5-(4-methylpiperidin-3-yl)oxypyrazolo[1,5-a]pyrimidine

5-(4-methylpiperidin-3-yl)oxypyrazolo[1,5-a]pyrimidine (PubChem CID 102954631) has the molecular formula C12H16N4O and a molecular weight of 232.29 g/mol. Its IUPAC name is 5-(4-methylpiperidin-3-yl)oxypyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name5-(4-methylpiperidin-3-yl)oxypyrazolo[1,5-a]pyrimidine
PubChem CID102954631
Molecular FormulaC12H16N4O
Molecular Weight232.29 g/mol
Exact Mass232.13
IUPAC Name5-(4-methylpiperidin-3-yl)oxypyrazolo[1,5-a]pyrimidine
SMILESCC1CCNCC1Oc1ccn2nccc2n1
InChIInChI=1S/C12H16N4O/c1-9-2-5-13-8-10(9)17-12-4-7-16-11(15-12)3-6-14-16/h3-4,6-7,9-10,13H,2,5,8H2,1H3
InChIKeyOJEOLBAPMDKJNF-UHFFFAOYSA-N
XLogP1.11
TPSA51.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.29
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-[(3R)-1-[(1-fluorocyclopropyl)methyl]piperidin-3-yl]oxy-N-piperidin-4-yl-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine
CID 171798681
5-[(3R)-1-[(1-fluorocyclopropyl)methyl]piperidin-3-yl]oxy-3-propan-2-ylpyrazolo[1,5-a]pyrimidine
CID 171798696
Propan-2-yl 4-[6-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]oxypiperidine-1-carboxylate
CID 57571032
2-Ethoxy-3-methylpyrazolo[1,5-a]pyrimidin-7-amine
CID 66584925
5-(cyclopropylmethoxy)-N-[(1-methylpyrazol-4-yl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine
CID 68031562
5-Hexoxypyrazolo[1,5-a]pyrimidine
CID 69331126
(S)-4-(piperidin-3-yloxy)-1-((2-(trimethylsilyl)ethoxy)methyl)-1H-pyrazolo[3,4-d]pyrimidine
CID 86706463
N-[2-(3-bromopyrazolo[1,5-a]pyrimidin-5-yl)oxyethyl]-3-pyrrolidin-1-ylpropan-1-amine
CID 89489508
2-Butoxy-3-ethylpyrazolo[1,5-a]pyrimidin-5-amine
CID 89810640
3-Bromo-5-piperidin-4-yloxypyrazolo[1,5-a]pyrimidine
CID 118975178
4-[2-(3-Iodopyrazolo[1,5-a]pyrimidin-7-yl)oxyethyl]morpholine
CID 129051466
4-[3-(3-Iodopyrazolo[1,5-a]pyrimidin-7-yl)oxypropyl]morpholine
CID 129051499

Frequently Asked Questions

What is the IUPAC name of 5-(4-methylpiperidin-3-yl)oxypyrazolo[1,5-a]pyrimidine?
The IUPAC name of 5-(4-methylpiperidin-3-yl)oxypyrazolo[1,5-a]pyrimidine (CID 102954631) is 5-(4-methylpiperidin-3-yl)oxypyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 5-(4-methylpiperidin-3-yl)oxypyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 5-(4-methylpiperidin-3-yl)oxypyrazolo[1,5-a]pyrimidine is CC1CCNCC1Oc1ccn2nccc2n1.
What is the InChIKey of 5-(4-methylpiperidin-3-yl)oxypyrazolo[1,5-a]pyrimidine?
The InChIKey is OJEOLBAPMDKJNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4O/c1-9-2-5-13-8-10(9)17-12-4-7-16-11(15-12)3-6-14-16/h3-4,6-7,9-10,13H,2,5,8H2,1H3.
What are the key properties of 5-(4-methylpiperidin-3-yl)oxypyrazolo[1,5-a]pyrimidine?
5-(4-methylpiperidin-3-yl)oxypyrazolo[1,5-a]pyrimidine has a molecular weight of 232.29 g/mol, XLogP of 1.11, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-methylpiperidin-3-yl)oxypyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 102954631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).