[(2R,3R)-2-methyloxan-3-yl]-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]methanone

C15H24N4O2 — CID 129399632

IUPAC[(2R,3R)-2-methyloxan-3-yl]-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]methanone
SMILESC[C@H]1OCCC[C@H]1C(=O)N1CCN(c2cnn(C)c2)CC1
InChIInChI=1S/C15H24N4O2/c1-12-14(4-3-9-21-12)15(20)19-7-5-18(6-8-19)13-10-16-17(2)11-13/h10-12,14H,3-9H2,1-2H3/t12-,14-/m1/s1
InChIKeyCBASNWLCICLPFJ-TZMCWYRMSA-N
MW292.38 g/mol
LogP0.88
Rot. Bonds2

About [(2R,3R)-2-methyloxan-3-yl]-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]methanone

[(2R,3R)-2-methyloxan-3-yl]-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]methanone (PubChem CID 129399632) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is [(2R,3R)-2-methyloxan-3-yl]-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]methanone.

Molecular Properties

Compound Name[(2R,3R)-2-methyloxan-3-yl]-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]methanone
PubChem CID129399632
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC Name[(2R,3R)-2-methyloxan-3-yl]-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]methanone
SMILESC[C@H]1OCCC[C@H]1C(=O)N1CCN(c2cnn(C)c2)CC1
InChIInChI=1S/C15H24N4O2/c1-12-14(4-3-9-21-12)15(20)19-7-5-18(6-8-19)13-10-16-17(2)11-13/h10-12,14H,3-9H2,1-2H3/t12-,14-/m1/s1
InChIKeyCBASNWLCICLPFJ-TZMCWYRMSA-N
XLogP0.88
TPSA50.60 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 50.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze [(2R,3R)-2-methyloxan-3-yl]-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]methanone with MolForge

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Related Compounds

[4-(1-methylpyrazol-4-yl)piperazin-1-yl]-[(1R,2S)-2-(oxan-4-yl)cyclopropyl]methanone
CID 136584830
[(2S,3R)-2-methyloxan-3-yl]-[4-(5-methyl-1H-pyrazol-3-yl)piperazin-1-yl]methanone
CID 129401181
[(1S,3S)-3-aminocyclohexyl]-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]methanone
CID 124696422
[4-[2-(2-hydroxyethyl)pyrazol-3-yl]piperidin-1-yl]-[(2S,3S)-2-methyloxan-3-yl]methanone
CID 154793910
[4-(1-methylpyrazol-4-yl)piperazin-1-yl]-piperidin-3-ylmethanone;dihydrochloride
CID 119887289
[4-(4-fluoro-2-methoxyphenyl)piperazin-1-yl]-[(2R,3R)-2-methyloxan-3-yl]methanone
CID 129401856
(2-methyloxan-3-yl)-[4-(1,2-oxazol-3-ylmethyl)piperazin-1-yl]methanone
CID 129000667
oxolan-2-yl-[4-(4-pyrrolidin-1-ylphenyl)piperazin-1-yl]methanone
CID 113078894
[(2R,3R)-2-ethyloxan-3-yl]-(4-pyridazin-3-ylpiperazin-1-yl)methanone
CID 129479295
2-(4-phenylpiperazine-1-carbonyl)cyclohexane-1-carboxylic acid
CID 2933500
[(2S,4S)-4-methoxy-1-methylpyrrolidin-2-yl]-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]methanone
CID 128985019
(3-aminophenyl)-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]methanone;dihydrochloride
CID 119887331

Frequently Asked Questions

What is the IUPAC name of [(2R,3R)-2-methyloxan-3-yl]-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]methanone?
The IUPAC name of [(2R,3R)-2-methyloxan-3-yl]-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]methanone (CID 129399632) is [(2R,3R)-2-methyloxan-3-yl]-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]methanone.
What is the SMILES notation for [(2R,3R)-2-methyloxan-3-yl]-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]methanone?
The canonical SMILES for [(2R,3R)-2-methyloxan-3-yl]-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]methanone is C[C@H]1OCCC[C@H]1C(=O)N1CCN(c2cnn(C)c2)CC1.
What is the InChIKey of [(2R,3R)-2-methyloxan-3-yl]-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]methanone?
The InChIKey is CBASNWLCICLPFJ-TZMCWYRMSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-12-14(4-3-9-21-12)15(20)19-7-5-18(6-8-19)13-10-16-17(2)11-13/h10-12,14H,3-9H2,1-2H3/t12-,14-/m1/s1.
What are the key properties of [(2R,3R)-2-methyloxan-3-yl]-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]methanone?
[(2R,3R)-2-methyloxan-3-yl]-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]methanone has a molecular weight of 292.38 g/mol, XLogP of 0.88, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R,3R)-2-methyloxan-3-yl]-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]methanone is sourced from PubChem (CID 129399632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).