1,3,4-tributylimidazolidin-2-one

C15H30N2O — CID 175192911

IUPAC1,3,4-tributylimidazolidin-2-one
SMILESCCCCC1CN(CCCC)C(=O)N1CCCC
InChIInChI=1S/C15H30N2O/c1-4-7-10-14-13-16(11-8-5-2)15(18)17(14)12-9-6-3/h14H,4-13H2,1-3H3
InChIKeyAZNIVPKVXFODMH-UHFFFAOYSA-N
MW254.42 g/mol
LogP3.88
Rot. Bonds9

About 1,3,4-tributylimidazolidin-2-one

1,3,4-tributylimidazolidin-2-one (PubChem CID 175192911) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is 1,3,4-tributylimidazolidin-2-one.

Molecular Properties

Compound Name1,3,4-tributylimidazolidin-2-one
PubChem CID175192911
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name1,3,4-tributylimidazolidin-2-one
SMILESCCCCC1CN(CCCC)C(=O)N1CCCC
InChIInChI=1S/C15H30N2O/c1-4-7-10-14-13-16(11-8-5-2)15(18)17(14)12-9-6-3/h14H,4-13H2,1-3H3
InChIKeyAZNIVPKVXFODMH-UHFFFAOYSA-N
XLogP3.88
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 53.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1,3,4-tributylimidazolidin-2-one?
The IUPAC name of 1,3,4-tributylimidazolidin-2-one (CID 175192911) is 1,3,4-tributylimidazolidin-2-one.
What is the SMILES notation for 1,3,4-tributylimidazolidin-2-one?
The canonical SMILES for 1,3,4-tributylimidazolidin-2-one is CCCCC1CN(CCCC)C(=O)N1CCCC.
What is the InChIKey of 1,3,4-tributylimidazolidin-2-one?
The InChIKey is AZNIVPKVXFODMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-4-7-10-14-13-16(11-8-5-2)15(18)17(14)12-9-6-3/h14H,4-13H2,1-3H3.
What are the key properties of 1,3,4-tributylimidazolidin-2-one?
1,3,4-tributylimidazolidin-2-one has a molecular weight of 254.42 g/mol, XLogP of 3.88, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3,4-tributylimidazolidin-2-one is sourced from PubChem (CID 175192911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).