1-[5-methoxy-6-(4-methylpiperazin-1-yl)-2-pyridinyl]-3-phenylimidazolidin-2-one

C20H25N5O2 — CID 53358683

IUPAC1-[5-methoxy-6-(4-methylpiperazin-1-yl)-2-pyridinyl]-3-phenylimidazolidin-2-one
SMILESCOc1ccc(N2CCN(c3ccccc3)C2=O)nc1N1CCN(C)CC1
InChIInChI=1S/C20H25N5O2/c1-22-10-12-23(13-11-22)19-17(27-2)8-9-18(21-19)25-15-14-24(20(25)26)16-6-4-3-5-7-16/h3-9H,10-15H2,1-2H3
InChIKeyGILOMCRLQGIPBR-UHFFFAOYSA-N
MW367.45 g/mol
LogP2.29
Rot. Bonds4

About 1-[5-methoxy-6-(4-methylpiperazin-1-yl)-2-pyridinyl]-3-phenylimidazolidin-2-one

1-[5-methoxy-6-(4-methylpiperazin-1-yl)-2-pyridinyl]-3-phenylimidazolidin-2-one (PubChem CID 53358683) has the molecular formula C20H25N5O2 and a molecular weight of 367.45 g/mol. Its IUPAC name is 1-[5-methoxy-6-(4-methylpiperazin-1-yl)-2-pyridinyl]-3-phenylimidazolidin-2-one.

Molecular Properties

Compound Name1-[5-methoxy-6-(4-methylpiperazin-1-yl)-2-pyridinyl]-3-phenylimidazolidin-2-one
PubChem CID53358683
Molecular FormulaC20H25N5O2
Molecular Weight367.45 g/mol
Exact Mass367.20
IUPAC Name1-[5-methoxy-6-(4-methylpiperazin-1-yl)-2-pyridinyl]-3-phenylimidazolidin-2-one
SMILESCOc1ccc(N2CCN(c3ccccc3)C2=O)nc1N1CCN(C)CC1
InChIInChI=1S/C20H25N5O2/c1-22-10-12-23(13-11-22)19-17(27-2)8-9-18(21-19)25-15-14-24(20(25)26)16-6-4-3-5-7-16/h3-9H,10-15H2,1-2H3
InChIKeyGILOMCRLQGIPBR-UHFFFAOYSA-N
XLogP2.29
TPSA52.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.45
LogP ≤ 52.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-[5-methoxy-6-(4-methylpiperazin-1-yl)-2-pyridinyl]-3-phenylimidazolidin-2-one?
The IUPAC name of 1-[5-methoxy-6-(4-methylpiperazin-1-yl)-2-pyridinyl]-3-phenylimidazolidin-2-one (CID 53358683) is 1-[5-methoxy-6-(4-methylpiperazin-1-yl)-2-pyridinyl]-3-phenylimidazolidin-2-one.
What is the SMILES notation for 1-[5-methoxy-6-(4-methylpiperazin-1-yl)-2-pyridinyl]-3-phenylimidazolidin-2-one?
The canonical SMILES for 1-[5-methoxy-6-(4-methylpiperazin-1-yl)-2-pyridinyl]-3-phenylimidazolidin-2-one is COc1ccc(N2CCN(c3ccccc3)C2=O)nc1N1CCN(C)CC1.
What is the InChIKey of 1-[5-methoxy-6-(4-methylpiperazin-1-yl)-2-pyridinyl]-3-phenylimidazolidin-2-one?
The InChIKey is GILOMCRLQGIPBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N5O2/c1-22-10-12-23(13-11-22)19-17(27-2)8-9-18(21-19)25-15-14-24(20(25)26)16-6-4-3-5-7-16/h3-9H,10-15H2,1-2H3.
What are the key properties of 1-[5-methoxy-6-(4-methylpiperazin-1-yl)-2-pyridinyl]-3-phenylimidazolidin-2-one?
1-[5-methoxy-6-(4-methylpiperazin-1-yl)-2-pyridinyl]-3-phenylimidazolidin-2-one has a molecular weight of 367.45 g/mol, XLogP of 2.29, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-methoxy-6-(4-methylpiperazin-1-yl)-2-pyridinyl]-3-phenylimidazolidin-2-one is sourced from PubChem (CID 53358683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).