3-(3-methoxypropyl)-2-(2-methylpropyl)-5-propylimidazolidin-4-one

C14H28N2O2 — CID 83243478

IUPAC3-(3-methoxypropyl)-2-(2-methylpropyl)-5-propylimidazolidin-4-one
SMILESCCCC1NC(CC(C)C)N(CCCOC)C1=O
InChIInChI=1S/C14H28N2O2/c1-5-7-12-14(17)16(8-6-9-18-4)13(15-12)10-11(2)3/h11-13,15H,5-10H2,1-4H3
InChIKeyMTLAMPGJXXYMJD-UHFFFAOYSA-N
MW256.39 g/mol
LogP2.00
Rot. Bonds8

About 3-(3-methoxypropyl)-2-(2-methylpropyl)-5-propylimidazolidin-4-one

3-(3-methoxypropyl)-2-(2-methylpropyl)-5-propylimidazolidin-4-one (PubChem CID 83243478) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is 3-(3-methoxypropyl)-2-(2-methylpropyl)-5-propylimidazolidin-4-one.

Molecular Properties

Compound Name3-(3-methoxypropyl)-2-(2-methylpropyl)-5-propylimidazolidin-4-one
PubChem CID83243478
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC Name3-(3-methoxypropyl)-2-(2-methylpropyl)-5-propylimidazolidin-4-one
SMILESCCCC1NC(CC(C)C)N(CCCOC)C1=O
InChIInChI=1S/C14H28N2O2/c1-5-7-12-14(17)16(8-6-9-18-4)13(15-12)10-11(2)3/h11-13,15H,5-10H2,1-4H3
InChIKeyMTLAMPGJXXYMJD-UHFFFAOYSA-N
XLogP2.00
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(2-methylpropyl)-3,5-dipropylimidazolidin-4-one
CID 83242530
5-butyl-3-(3-methoxypropyl)-2-propylimidazolidin-4-one
CID 83243884
2-(2-methylpropyl)-5-propyl-3-(3-pyrrolidin-1-ylpropyl)imidazolidin-4-one
CID 83249859
5-ethyl-2-(2-methylpropyl)-3-(3-propoxypropyl)imidazolidin-4-one
CID 83260919
1-(3-methoxypropyl)-6-propan-2-yl-3-propylpiperazine-2,5-dione
CID 64872775
2-ethyl-5-(2-methylpropyl)-3-(3-propoxypropyl)imidazolidin-4-one
CID 83260824
5-ethyl-2-(2-methylpropyl)-3-octylimidazolidin-4-one
CID 83260459
3-(3-methoxypropyl)-5-(2-methylpropyl)-2-propan-2-ylimidazolidin-4-one
CID 83243563
3-(4-methylpentyl)-2,5-bis(2-methylpropyl)imidazolidin-4-one
CID 83254863
3-(2-butoxyethyl)-5-(2-methylpropyl)-2-propylimidazolidin-4-one
CID 83253671
3-(1-methoxypentan-2-yl)-2-(2-methylpropyl)-5-propylimidazolidin-4-one
CID 83262701
3-pentyl-2,5-dipropylimidazolidin-4-one
CID 83250379

Frequently Asked Questions

What is the IUPAC name of 3-(3-methoxypropyl)-2-(2-methylpropyl)-5-propylimidazolidin-4-one?
The IUPAC name of 3-(3-methoxypropyl)-2-(2-methylpropyl)-5-propylimidazolidin-4-one (CID 83243478) is 3-(3-methoxypropyl)-2-(2-methylpropyl)-5-propylimidazolidin-4-one.
What is the SMILES notation for 3-(3-methoxypropyl)-2-(2-methylpropyl)-5-propylimidazolidin-4-one?
The canonical SMILES for 3-(3-methoxypropyl)-2-(2-methylpropyl)-5-propylimidazolidin-4-one is CCCC1NC(CC(C)C)N(CCCOC)C1=O.
What is the InChIKey of 3-(3-methoxypropyl)-2-(2-methylpropyl)-5-propylimidazolidin-4-one?
The InChIKey is MTLAMPGJXXYMJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-5-7-12-14(17)16(8-6-9-18-4)13(15-12)10-11(2)3/h11-13,15H,5-10H2,1-4H3.
What are the key properties of 3-(3-methoxypropyl)-2-(2-methylpropyl)-5-propylimidazolidin-4-one?
3-(3-methoxypropyl)-2-(2-methylpropyl)-5-propylimidazolidin-4-one has a molecular weight of 256.39 g/mol, XLogP of 2.00, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-methoxypropyl)-2-(2-methylpropyl)-5-propylimidazolidin-4-one is sourced from PubChem (CID 83243478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).