7-[4-(4-methoxyphenoxy)piperidin-1-yl]-5-methylpyrazolo[1,5-a]pyrimidine

C19H22N4O2 — CID 56899517

IUPAC7-[4-(4-methoxyphenoxy)piperidin-1-yl]-5-methylpyrazolo[1,5-a]pyrimidine
SMILESCOc1ccc(OC2CCN(c3cc(C)nc4ccnn34)CC2)cc1
InChIInChI=1S/C19H22N4O2/c1-14-13-19(23-18(21-14)7-10-20-23)22-11-8-17(9-12-22)25-16-5-3-15(24-2)4-6-16/h3-7,10,13,17H,8-9,11-12H2,1-2H3
InChIKeyBMUUGMJQBUZSPI-UHFFFAOYSA-N
MW338.41 g/mol
LogP3.09
Rot. Bonds4

About 7-[4-(4-methoxyphenoxy)piperidin-1-yl]-5-methylpyrazolo[1,5-a]pyrimidine

7-[4-(4-methoxyphenoxy)piperidin-1-yl]-5-methylpyrazolo[1,5-a]pyrimidine (PubChem CID 56899517) has the molecular formula C19H22N4O2 and a molecular weight of 338.41 g/mol. Its IUPAC name is 7-[4-(4-methoxyphenoxy)piperidin-1-yl]-5-methylpyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name7-[4-(4-methoxyphenoxy)piperidin-1-yl]-5-methylpyrazolo[1,5-a]pyrimidine
PubChem CID56899517
Molecular FormulaC19H22N4O2
Molecular Weight338.41 g/mol
Exact Mass338.17
IUPAC Name7-[4-(4-methoxyphenoxy)piperidin-1-yl]-5-methylpyrazolo[1,5-a]pyrimidine
SMILESCOc1ccc(OC2CCN(c3cc(C)nc4ccnn34)CC2)cc1
InChIInChI=1S/C19H22N4O2/c1-14-13-19(23-18(21-14)7-10-20-23)22-11-8-17(9-12-22)25-16-5-3-15(24-2)4-6-16/h3-7,10,13,17H,8-9,11-12H2,1-2H3
InChIKeyBMUUGMJQBUZSPI-UHFFFAOYSA-N
XLogP3.09
TPSA51.89 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.41
LogP ≤ 53.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

5-methyl-7-(4-pyridin-3-yloxypiperidin-1-yl)pyrazolo[1,5-a]pyrimidine
CID 56916689
2,5-dimethyl-7-(4-pyrazolo[1,5-a]pyrimidin-5-yloxypiperidin-1-yl)pyrazolo[1,5-a]pyrimidine
CID 163354425
4-N-cyclopropyl-6-N,6-N-dimethyl-4-N-[1-(5-methylpyrazolo[1,5-a]pyrimidin-7-yl)piperidin-4-yl]pyrimidine-4,6-diamine
CID 126891656
5-methyl-7-(4-pyrazolo[1,5-a]pyrimidin-5-yloxypiperidin-1-yl)-[1,2,4]triazolo[1,5-a]pyrimidine
CID 163354956
1-(5-methylpyrazolo[1,5-a]pyrimidin-7-yl)-N-(oxan-4-yl)piperidine-4-carboxamide
CID 171993207
2-[1-(5-methylpyrazolo[1,5-a]pyrimidin-7-yl)piperidin-4-yl]-1-morpholin-4-ylethanone
CID 172899976
2-methyl-N-[1-(5-methylpyrazolo[1,5-a]pyrimidin-7-yl)piperidin-4-yl]pyrazole-3-carboxamide
CID 172892022
7-[3-(fluoromethyl)piperidin-1-yl]-5-methylpyrazolo[1,5-a]pyrimidine
CID 163343464
7-[(3R)-3-methoxypyrrolidin-1-yl]-5-phenylpyrazolo[1,5-a]pyrimidine
CID 95861445
2-[4-(5-methylpyrazolo[1,5-a]pyrimidin-7-yl)piperazin-1-yl]-1,3-benzoxazole
CID 70745553
7-[4-(benzenesulfonyl)piperazin-1-yl]-5-methylpyrazolo[1,5-a]pyrimidine
CID 56902175
6-[4-(5-methylpyrazolo[1,5-a]pyrimidin-7-yl)piperazin-1-yl]-[1,2,4]triazolo[4,3-b]pyridazine
CID 139027758

Frequently Asked Questions

What is the IUPAC name of 7-[4-(4-methoxyphenoxy)piperidin-1-yl]-5-methylpyrazolo[1,5-a]pyrimidine?
The IUPAC name of 7-[4-(4-methoxyphenoxy)piperidin-1-yl]-5-methylpyrazolo[1,5-a]pyrimidine (CID 56899517) is 7-[4-(4-methoxyphenoxy)piperidin-1-yl]-5-methylpyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 7-[4-(4-methoxyphenoxy)piperidin-1-yl]-5-methylpyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 7-[4-(4-methoxyphenoxy)piperidin-1-yl]-5-methylpyrazolo[1,5-a]pyrimidine is COc1ccc(OC2CCN(c3cc(C)nc4ccnn34)CC2)cc1.
What is the InChIKey of 7-[4-(4-methoxyphenoxy)piperidin-1-yl]-5-methylpyrazolo[1,5-a]pyrimidine?
The InChIKey is BMUUGMJQBUZSPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O2/c1-14-13-19(23-18(21-14)7-10-20-23)22-11-8-17(9-12-22)25-16-5-3-15(24-2)4-6-16/h3-7,10,13,17H,8-9,11-12H2,1-2H3.
What are the key properties of 7-[4-(4-methoxyphenoxy)piperidin-1-yl]-5-methylpyrazolo[1,5-a]pyrimidine?
7-[4-(4-methoxyphenoxy)piperidin-1-yl]-5-methylpyrazolo[1,5-a]pyrimidine has a molecular weight of 338.41 g/mol, XLogP of 3.09, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[4-(4-methoxyphenoxy)piperidin-1-yl]-5-methylpyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 56899517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).