(2-methylpyrazol-3-yl)-[(2R)-2-phenylpiperazin-1-yl]methanone

C15H18N4O — CID 124995782

IUPAC(2-methylpyrazol-3-yl)-[(2R)-2-phenylpiperazin-1-yl]methanone
SMILESCn1nccc1C(=O)N1CCNC[C@H]1c1ccccc1
InChIInChI=1S/C15H18N4O/c1-18-13(7-8-17-18)15(20)19-10-9-16-11-14(19)12-5-3-2-4-6-12/h2-8,14,16H,9-11H2,1H3/t14-/m0/s1
InChIKeyQOMNPORDISITQB-AWEZNQCLSA-N
MW270.34 g/mol
LogP1.21
Rot. Bonds2

About (2-methylpyrazol-3-yl)-[(2R)-2-phenylpiperazin-1-yl]methanone

(2-methylpyrazol-3-yl)-[(2R)-2-phenylpiperazin-1-yl]methanone (PubChem CID 124995782) has the molecular formula C15H18N4O and a molecular weight of 270.34 g/mol. Its IUPAC name is (2-methylpyrazol-3-yl)-[(2R)-2-phenylpiperazin-1-yl]methanone.

Molecular Properties

Compound Name(2-methylpyrazol-3-yl)-[(2R)-2-phenylpiperazin-1-yl]methanone
PubChem CID124995782
Molecular FormulaC15H18N4O
Molecular Weight270.34 g/mol
Exact Mass270.15
IUPAC Name(2-methylpyrazol-3-yl)-[(2R)-2-phenylpiperazin-1-yl]methanone
SMILESCn1nccc1C(=O)N1CCNC[C@H]1c1ccccc1
InChIInChI=1S/C15H18N4O/c1-18-13(7-8-17-18)15(20)19-10-9-16-11-14(19)12-5-3-2-4-6-12/h2-8,14,16H,9-11H2,1H3/t14-/m0/s1
InChIKeyQOMNPORDISITQB-AWEZNQCLSA-N
XLogP1.21
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[(3S)-4-(2-methylpyrazole-3-carbonyl)-3-phenylpiperazin-1-yl]ethanone
CID 124986438
(1-methylpyrazol-3-yl)-[(2S)-2-phenylpiperazin-1-yl]methanone
CID 125020826
[(2S)-2-phenylpiperazin-1-yl]-pyridin-3-ylmethanone
CID 94993839
2-phenylpiperazine-1-carbonyl chloride
CID 154387784
1-(2-phenylpiperazin-1-yl)propan-1-one
CID 73440047
(1-methylpyrrol-2-yl)-(2-pyridin-3-ylpiperazin-1-yl)methanone
CID 120731694
6-methyl-4-[(2S)-2-phenylpiperazine-1-carbonyl]-1H-pyrimidin-2-one
CID 124948429
(2-methoxyphenyl)-[(2R)-2-phenylpiperazin-1-yl]methanone
CID 95001107
1-(2-phenylpiperazin-1-yl)butane-1,3-dione
CID 110477449
(2-methylpyrazol-3-yl)-piperazin-1-ylmethanone;dihydrochloride
CID 126965683
(3-fluorophenyl)-[(2R)-2-phenylpiperazin-1-yl]methanone
CID 94997806
1-[1-methyl-5-(2-pyridin-3-ylpiperazine-1-carbonyl)pyrrol-3-yl]ethanone;hydrochloride
CID 120732596

Frequently Asked Questions

What is the IUPAC name of (2-methylpyrazol-3-yl)-[(2R)-2-phenylpiperazin-1-yl]methanone?
The IUPAC name of (2-methylpyrazol-3-yl)-[(2R)-2-phenylpiperazin-1-yl]methanone (CID 124995782) is (2-methylpyrazol-3-yl)-[(2R)-2-phenylpiperazin-1-yl]methanone.
What is the SMILES notation for (2-methylpyrazol-3-yl)-[(2R)-2-phenylpiperazin-1-yl]methanone?
The canonical SMILES for (2-methylpyrazol-3-yl)-[(2R)-2-phenylpiperazin-1-yl]methanone is Cn1nccc1C(=O)N1CCNC[C@H]1c1ccccc1.
What is the InChIKey of (2-methylpyrazol-3-yl)-[(2R)-2-phenylpiperazin-1-yl]methanone?
The InChIKey is QOMNPORDISITQB-AWEZNQCLSA-N. The full InChI is InChI=1S/C15H18N4O/c1-18-13(7-8-17-18)15(20)19-10-9-16-11-14(19)12-5-3-2-4-6-12/h2-8,14,16H,9-11H2,1H3/t14-/m0/s1.
What are the key properties of (2-methylpyrazol-3-yl)-[(2R)-2-phenylpiperazin-1-yl]methanone?
(2-methylpyrazol-3-yl)-[(2R)-2-phenylpiperazin-1-yl]methanone has a molecular weight of 270.34 g/mol, XLogP of 1.21, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylpyrazol-3-yl)-[(2R)-2-phenylpiperazin-1-yl]methanone is sourced from PubChem (CID 124995782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).