[(2R)-morpholin-2-yl]-[4-(4-phenylpyrimidin-2-yl)piperazin-1-yl]methanone

C19H23N5O2 — CID 125178265

IUPAC[(2R)-morpholin-2-yl]-[4-(4-phenylpyrimidin-2-yl)piperazin-1-yl]methanone
SMILESO=C([C@H]1CNCCO1)N1CCN(c2nccc(-c3ccccc3)n2)CC1
InChIInChI=1S/C19H23N5O2/c25-18(17-14-20-8-13-26-17)23-9-11-24(12-10-23)19-21-7-6-16(22-19)15-4-2-1-3-5-15/h1-7,17,20H,8-14H2/t17-/m1/s1
InChIKeyUUARQMQSXKCFDL-QGZVFWFLSA-N
MW353.43 g/mol
LogP0.78
Rot. Bonds3

About [(2R)-morpholin-2-yl]-[4-(4-phenylpyrimidin-2-yl)piperazin-1-yl]methanone

[(2R)-morpholin-2-yl]-[4-(4-phenylpyrimidin-2-yl)piperazin-1-yl]methanone (PubChem CID 125178265) has the molecular formula C19H23N5O2 and a molecular weight of 353.43 g/mol. Its IUPAC name is [(2R)-morpholin-2-yl]-[4-(4-phenylpyrimidin-2-yl)piperazin-1-yl]methanone.

Molecular Properties

Compound Name[(2R)-morpholin-2-yl]-[4-(4-phenylpyrimidin-2-yl)piperazin-1-yl]methanone
PubChem CID125178265
Molecular FormulaC19H23N5O2
Molecular Weight353.43 g/mol
Exact Mass353.19
IUPAC Name[(2R)-morpholin-2-yl]-[4-(4-phenylpyrimidin-2-yl)piperazin-1-yl]methanone
SMILESO=C([C@H]1CNCCO1)N1CCN(c2nccc(-c3ccccc3)n2)CC1
InChIInChI=1S/C19H23N5O2/c25-18(17-14-20-8-13-26-17)23-9-11-24(12-10-23)19-21-7-6-16(22-19)15-4-2-1-3-5-15/h1-7,17,20H,8-14H2/t17-/m1/s1
InChIKeyUUARQMQSXKCFDL-QGZVFWFLSA-N
XLogP0.78
TPSA70.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.43
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [(2R)-morpholin-2-yl]-[4-(4-phenylpyrimidin-2-yl)piperazin-1-yl]methanone?
The IUPAC name of [(2R)-morpholin-2-yl]-[4-(4-phenylpyrimidin-2-yl)piperazin-1-yl]methanone (CID 125178265) is [(2R)-morpholin-2-yl]-[4-(4-phenylpyrimidin-2-yl)piperazin-1-yl]methanone.
What is the SMILES notation for [(2R)-morpholin-2-yl]-[4-(4-phenylpyrimidin-2-yl)piperazin-1-yl]methanone?
The canonical SMILES for [(2R)-morpholin-2-yl]-[4-(4-phenylpyrimidin-2-yl)piperazin-1-yl]methanone is O=C([C@H]1CNCCO1)N1CCN(c2nccc(-c3ccccc3)n2)CC1.
What is the InChIKey of [(2R)-morpholin-2-yl]-[4-(4-phenylpyrimidin-2-yl)piperazin-1-yl]methanone?
The InChIKey is UUARQMQSXKCFDL-QGZVFWFLSA-N. The full InChI is InChI=1S/C19H23N5O2/c25-18(17-14-20-8-13-26-17)23-9-11-24(12-10-23)19-21-7-6-16(22-19)15-4-2-1-3-5-15/h1-7,17,20H,8-14H2/t17-/m1/s1.
What are the key properties of [(2R)-morpholin-2-yl]-[4-(4-phenylpyrimidin-2-yl)piperazin-1-yl]methanone?
[(2R)-morpholin-2-yl]-[4-(4-phenylpyrimidin-2-yl)piperazin-1-yl]methanone has a molecular weight of 353.43 g/mol, XLogP of 0.78, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-morpholin-2-yl]-[4-(4-phenylpyrimidin-2-yl)piperazin-1-yl]methanone is sourced from PubChem (CID 125178265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).