[4-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-5-yl)piperidin-1-yl]-[(2R)-oxan-2-yl]methanone

C19H26N4O2 — CID 124999857

IUPAC[4-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-5-yl)piperidin-1-yl]-[(2R)-oxan-2-yl]methanone
SMILESCc1cc2nc(C3CCN(C(=O)[C@H]4CCCCO4)CC3)cc(C)n2n1
InChIInChI=1S/C19H26N4O2/c1-13-11-18-20-16(12-14(2)23(18)21-13)15-6-8-22(9-7-15)19(24)17-5-3-4-10-25-17/h11-12,15,17H,3-10H2,1-2H3/t17-/m1/s1
InChIKeyRRSXBVTVKDXPOM-QGZVFWFLSA-N
MW342.44 g/mol
LogP2.62
Rot. Bonds2

About [4-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-5-yl)piperidin-1-yl]-[(2R)-oxan-2-yl]methanone

[4-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-5-yl)piperidin-1-yl]-[(2R)-oxan-2-yl]methanone (PubChem CID 124999857) has the molecular formula C19H26N4O2 and a molecular weight of 342.44 g/mol. Its IUPAC name is [4-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-5-yl)piperidin-1-yl]-[(2R)-oxan-2-yl]methanone.

Molecular Properties

Compound Name[4-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-5-yl)piperidin-1-yl]-[(2R)-oxan-2-yl]methanone
PubChem CID124999857
Molecular FormulaC19H26N4O2
Molecular Weight342.44 g/mol
Exact Mass342.21
IUPAC Name[4-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-5-yl)piperidin-1-yl]-[(2R)-oxan-2-yl]methanone
SMILESCc1cc2nc(C3CCN(C(=O)[C@H]4CCCCO4)CC3)cc(C)n2n1
InChIInChI=1S/C19H26N4O2/c1-13-11-18-20-16(12-14(2)23(18)21-13)15-6-8-22(9-7-15)19(24)17-5-3-4-10-25-17/h11-12,15,17H,3-10H2,1-2H3/t17-/m1/s1
InChIKeyRRSXBVTVKDXPOM-QGZVFWFLSA-N
XLogP2.62
TPSA59.73 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.44
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze [4-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-5-yl)piperidin-1-yl]-[(2R)-oxan-2-yl]methanone with MolForge

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Related Compounds

2-methyl-5-[1-[(2S)-oxane-2-carbonyl]piperidin-4-yl]-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 124977155
2-methyl-5-[1-(oxane-2-carbonyl)piperidin-4-yl]-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 110132890
[4-[4-[(4-chlorophenyl)methyl]-6-methyl-2-pyridinyl]piperidin-1-yl]-[(2S)-oxolan-2-yl]methanone
CID 92616961
2-(5-methylpyrazin-2-yl)-4-[1-[(2S)-oxolane-2-carbonyl]piperidin-4-yl]-1H-pyrimidin-6-one
CID 136874984
[4-(2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-yl)morpholin-2-yl]-piperidin-1-ylmethanone
CID 163343507
[4-[4-[(2-chlorophenyl)methyl]-6-methyl-2-pyridinyl]piperidin-1-yl]-(oxolan-2-yl)methanone
CID 110263682
oxolan-2-yl-[4-[7-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]methanone
CID 46954977
[4-(2,3-dimethylimidazo[1,2-b]pyridazin-6-yl)piperazin-1-yl]-(oxolan-2-yl)methanone
CID 163352851
azepan-1-yl(oxan-2-yl)methanone
CID 64592467
[4-(6-methyl-1H-benzimidazol-2-yl)piperidin-1-yl]-[(2R)-oxolan-2-yl]methanone
CID 99780038
(4-methylpiperazin-1-yl)-(oxan-2-yl)methanone
CID 64593251
(2R)-N-(7-chloro-2-methylpyrazolo[1,5-a]pyrimidin-5-yl)oxolane-2-carboxamide
CID 126826055

Frequently Asked Questions

What is the IUPAC name of [4-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-5-yl)piperidin-1-yl]-[(2R)-oxan-2-yl]methanone?
The IUPAC name of [4-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-5-yl)piperidin-1-yl]-[(2R)-oxan-2-yl]methanone (CID 124999857) is [4-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-5-yl)piperidin-1-yl]-[(2R)-oxan-2-yl]methanone.
What is the SMILES notation for [4-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-5-yl)piperidin-1-yl]-[(2R)-oxan-2-yl]methanone?
The canonical SMILES for [4-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-5-yl)piperidin-1-yl]-[(2R)-oxan-2-yl]methanone is Cc1cc2nc(C3CCN(C(=O)[C@H]4CCCCO4)CC3)cc(C)n2n1.
What is the InChIKey of [4-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-5-yl)piperidin-1-yl]-[(2R)-oxan-2-yl]methanone?
The InChIKey is RRSXBVTVKDXPOM-QGZVFWFLSA-N. The full InChI is InChI=1S/C19H26N4O2/c1-13-11-18-20-16(12-14(2)23(18)21-13)15-6-8-22(9-7-15)19(24)17-5-3-4-10-25-17/h11-12,15,17H,3-10H2,1-2H3/t17-/m1/s1.
What are the key properties of [4-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-5-yl)piperidin-1-yl]-[(2R)-oxan-2-yl]methanone?
[4-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-5-yl)piperidin-1-yl]-[(2R)-oxan-2-yl]methanone has a molecular weight of 342.44 g/mol, XLogP of 2.62, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-5-yl)piperidin-1-yl]-[(2R)-oxan-2-yl]methanone is sourced from PubChem (CID 124999857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).