2-methyl-5-(2-methylpropyl)-3-[1-(oxolan-2-yl)ethyl]imidazolidin-4-one

C14H26N2O2 — CID 83243387

IUPAC2-methyl-5-(2-methylpropyl)-3-[1-(oxolan-2-yl)ethyl]imidazolidin-4-one
SMILESCC(C)CC1NC(C)N(C(C)C2CCCO2)C1=O
InChIInChI=1S/C14H26N2O2/c1-9(2)8-12-14(17)16(11(4)15-12)10(3)13-6-5-7-18-13/h9-13,15H,5-8H2,1-4H3
InChIKeyMPWOOOBRLRGWMN-UHFFFAOYSA-N
MW254.37 g/mol
LogP1.75
Rot. Bonds4

About 2-methyl-5-(2-methylpropyl)-3-[1-(oxolan-2-yl)ethyl]imidazolidin-4-one

2-methyl-5-(2-methylpropyl)-3-[1-(oxolan-2-yl)ethyl]imidazolidin-4-one (PubChem CID 83243387) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is 2-methyl-5-(2-methylpropyl)-3-[1-(oxolan-2-yl)ethyl]imidazolidin-4-one.

Molecular Properties

Compound Name2-methyl-5-(2-methylpropyl)-3-[1-(oxolan-2-yl)ethyl]imidazolidin-4-one
PubChem CID83243387
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC Name2-methyl-5-(2-methylpropyl)-3-[1-(oxolan-2-yl)ethyl]imidazolidin-4-one
SMILESCC(C)CC1NC(C)N(C(C)C2CCCO2)C1=O
InChIInChI=1S/C14H26N2O2/c1-9(2)8-12-14(17)16(11(4)15-12)10(3)13-6-5-7-18-13/h9-13,15H,5-8H2,1-4H3
InChIKeyMPWOOOBRLRGWMN-UHFFFAOYSA-N
XLogP1.75
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-(2-methylpropyl)-3-[1-(oxolan-2-yl)ethyl]imidazolidin-4-one?
The IUPAC name of 2-methyl-5-(2-methylpropyl)-3-[1-(oxolan-2-yl)ethyl]imidazolidin-4-one (CID 83243387) is 2-methyl-5-(2-methylpropyl)-3-[1-(oxolan-2-yl)ethyl]imidazolidin-4-one.
What is the SMILES notation for 2-methyl-5-(2-methylpropyl)-3-[1-(oxolan-2-yl)ethyl]imidazolidin-4-one?
The canonical SMILES for 2-methyl-5-(2-methylpropyl)-3-[1-(oxolan-2-yl)ethyl]imidazolidin-4-one is CC(C)CC1NC(C)N(C(C)C2CCCO2)C1=O.
What is the InChIKey of 2-methyl-5-(2-methylpropyl)-3-[1-(oxolan-2-yl)ethyl]imidazolidin-4-one?
The InChIKey is MPWOOOBRLRGWMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-9(2)8-12-14(17)16(11(4)15-12)10(3)13-6-5-7-18-13/h9-13,15H,5-8H2,1-4H3.
What are the key properties of 2-methyl-5-(2-methylpropyl)-3-[1-(oxolan-2-yl)ethyl]imidazolidin-4-one?
2-methyl-5-(2-methylpropyl)-3-[1-(oxolan-2-yl)ethyl]imidazolidin-4-one has a molecular weight of 254.37 g/mol, XLogP of 1.75, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-(2-methylpropyl)-3-[1-(oxolan-2-yl)ethyl]imidazolidin-4-one is sourced from PubChem (CID 83243387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).