1-[1-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]piperidin-4-yl]imidazolidin-2-one

C19H28N4O — CID 75434932

IUPAC1-[1-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]piperidin-4-yl]imidazolidin-2-one
SMILESO=C1NCCN1C1CCN(CCN2CCCc3ccccc32)CC1
InChIInChI=1S/C19H28N4O/c24-19-20-9-13-23(19)17-7-11-21(12-8-17)14-15-22-10-3-5-16-4-1-2-6-18(16)22/h1-2,4,6,17H,3,5,7-15H2,(H,20,24)
InChIKeyCBXRISDFEZIZPY-UHFFFAOYSA-N
MW328.46 g/mol
LogP1.93
Rot. Bonds4

About 1-[1-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]piperidin-4-yl]imidazolidin-2-one

1-[1-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]piperidin-4-yl]imidazolidin-2-one (PubChem CID 75434932) has the molecular formula C19H28N4O and a molecular weight of 328.46 g/mol. Its IUPAC name is 1-[1-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]piperidin-4-yl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[1-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]piperidin-4-yl]imidazolidin-2-one
PubChem CID75434932
Molecular FormulaC19H28N4O
Molecular Weight328.46 g/mol
Exact Mass328.23
IUPAC Name1-[1-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]piperidin-4-yl]imidazolidin-2-one
SMILESO=C1NCCN1C1CCN(CCN2CCCc3ccccc32)CC1
InChIInChI=1S/C19H28N4O/c24-19-20-9-13-23(19)17-7-11-21(12-8-17)14-15-22-10-3-5-16-4-1-2-6-18(16)22/h1-2,4,6,17H,3,5,7-15H2,(H,20,24)
InChIKeyCBXRISDFEZIZPY-UHFFFAOYSA-N
XLogP1.93
TPSA38.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.46
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[1-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]piperidin-4-yl]imidazolidin-2-one?
The IUPAC name of 1-[1-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]piperidin-4-yl]imidazolidin-2-one (CID 75434932) is 1-[1-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]piperidin-4-yl]imidazolidin-2-one.
What is the SMILES notation for 1-[1-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]piperidin-4-yl]imidazolidin-2-one?
The canonical SMILES for 1-[1-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]piperidin-4-yl]imidazolidin-2-one is O=C1NCCN1C1CCN(CCN2CCCc3ccccc32)CC1.
What is the InChIKey of 1-[1-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]piperidin-4-yl]imidazolidin-2-one?
The InChIKey is CBXRISDFEZIZPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N4O/c24-19-20-9-13-23(19)17-7-11-21(12-8-17)14-15-22-10-3-5-16-4-1-2-6-18(16)22/h1-2,4,6,17H,3,5,7-15H2,(H,20,24).
What are the key properties of 1-[1-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]piperidin-4-yl]imidazolidin-2-one?
1-[1-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]piperidin-4-yl]imidazolidin-2-one has a molecular weight of 328.46 g/mol, XLogP of 1.93, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]piperidin-4-yl]imidazolidin-2-one is sourced from PubChem (CID 75434932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).