4-propylimino-5-quinolin-8-ylimidazolidin-2-one

C15H16N4O — CID 140604914

IUPAC4-propylimino-5-quinolin-8-ylimidazolidin-2-one
SMILESCCC/N=C1\NC(=O)NC1c1cccc2cccnc12
InChIInChI=1S/C15H16N4O/c1-2-8-17-14-13(18-15(20)19-14)11-7-3-5-10-6-4-9-16-12(10)11/h3-7,9,13H,2,8H2,1H3,(H2,17,18,19,20)
InChIKeyQFTICBZLTLVAIG-UHFFFAOYSA-N
MW268.32 g/mol
LogP2.40
Rot. Bonds3

About 4-propylimino-5-quinolin-8-ylimidazolidin-2-one

4-propylimino-5-quinolin-8-ylimidazolidin-2-one (PubChem CID 140604914) has the molecular formula C15H16N4O and a molecular weight of 268.32 g/mol. Its IUPAC name is 4-propylimino-5-quinolin-8-ylimidazolidin-2-one.

Molecular Properties

Compound Name4-propylimino-5-quinolin-8-ylimidazolidin-2-one
PubChem CID140604914
Molecular FormulaC15H16N4O
Molecular Weight268.32 g/mol
Exact Mass268.13
IUPAC Name4-propylimino-5-quinolin-8-ylimidazolidin-2-one
SMILESCCC/N=C1\NC(=O)NC1c1cccc2cccnc12
InChIInChI=1S/C15H16N4O/c1-2-8-17-14-13(18-15(20)19-14)11-7-3-5-10-6-4-9-16-12(10)11/h3-7,9,13H,2,8H2,1H3,(H2,17,18,19,20)
InChIKeyQFTICBZLTLVAIG-UHFFFAOYSA-N
XLogP2.40
TPSA66.38 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

8-cyclopropylquinoline
CID 66823369
(4R)-3-methyl-2-propyl-4-quinolin-8-yl-5,7-dihydro-4H-pyrazolo[3,4-b]pyridin-6-one
CID 136907532
3-(ethylamino)-1,3-dihydropyrrolo[3,2-h]quinolin-2-one
CID 114988376
N-[(2-quinolin-8-ylcyclobutyl)methyl]ethanamine
CID 81223017
8-(2,3-dihydro-1H-isoindol-1-yl)quinoline
CID 81224395
8-[(2S)-pyrrolidin-2-yl]quinoline;dihydrochloride
CID 154574794
8-pyrrolidin-3-ylquinoline;hydrochloride
CID 169498293
N-[(2-quinolin-8-ylcyclopropyl)methyl]ethanamine
CID 63973584
2,4-dimethyl-6-quinolin-8-yl-1,2,4,5-tetrazinane-3-thione
CID 139175591
ethyl 4-quinolin-8-ylpyrrolidine-3-carboxylate
CID 114486851
2-quinolin-8-ylcyclohexan-1-amine
CID 81224075
2-methyl-N-[(2-quinolin-8-yloxolan-3-yl)methyl]propan-2-amine
CID 79370305

Frequently Asked Questions

What is the IUPAC name of 4-propylimino-5-quinolin-8-ylimidazolidin-2-one?
The IUPAC name of 4-propylimino-5-quinolin-8-ylimidazolidin-2-one (CID 140604914) is 4-propylimino-5-quinolin-8-ylimidazolidin-2-one.
What is the SMILES notation for 4-propylimino-5-quinolin-8-ylimidazolidin-2-one?
The canonical SMILES for 4-propylimino-5-quinolin-8-ylimidazolidin-2-one is CCC/N=C1\NC(=O)NC1c1cccc2cccnc12.
What is the InChIKey of 4-propylimino-5-quinolin-8-ylimidazolidin-2-one?
The InChIKey is QFTICBZLTLVAIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O/c1-2-8-17-14-13(18-15(20)19-14)11-7-3-5-10-6-4-9-16-12(10)11/h3-7,9,13H,2,8H2,1H3,(H2,17,18,19,20).
What are the key properties of 4-propylimino-5-quinolin-8-ylimidazolidin-2-one?
4-propylimino-5-quinolin-8-ylimidazolidin-2-one has a molecular weight of 268.32 g/mol, XLogP of 2.40, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-propylimino-5-quinolin-8-ylimidazolidin-2-one is sourced from PubChem (CID 140604914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).