2-cyclopentyl-3-(3-methylbutyl)-5-propan-2-ylimidazolidin-4-one

C16H30N2O — CID 83238286

IUPAC2-cyclopentyl-3-(3-methylbutyl)-5-propan-2-ylimidazolidin-4-one
SMILESCC(C)CCN1C(=O)C(C(C)C)NC1C1CCCC1
InChIInChI=1S/C16H30N2O/c1-11(2)9-10-18-15(13-7-5-6-8-13)17-14(12(3)4)16(18)19/h11-15,17H,5-10H2,1-4H3
InChIKeyWSXMEYAZEJMICI-UHFFFAOYSA-N
MW266.43 g/mol
LogP3.01
Rot. Bonds5

About 2-cyclopentyl-3-(3-methylbutyl)-5-propan-2-ylimidazolidin-4-one

2-cyclopentyl-3-(3-methylbutyl)-5-propan-2-ylimidazolidin-4-one (PubChem CID 83238286) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is 2-cyclopentyl-3-(3-methylbutyl)-5-propan-2-ylimidazolidin-4-one.

Molecular Properties

Compound Name2-cyclopentyl-3-(3-methylbutyl)-5-propan-2-ylimidazolidin-4-one
PubChem CID83238286
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC Name2-cyclopentyl-3-(3-methylbutyl)-5-propan-2-ylimidazolidin-4-one
SMILESCC(C)CCN1C(=O)C(C(C)C)NC1C1CCCC1
InChIInChI=1S/C16H30N2O/c1-11(2)9-10-18-15(13-7-5-6-8-13)17-14(12(3)4)16(18)19/h11-15,17H,5-10H2,1-4H3
InChIKeyWSXMEYAZEJMICI-UHFFFAOYSA-N
XLogP3.01
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-3-(3-methylbutyl)-5-propan-2-ylimidazolidin-4-one?
The IUPAC name of 2-cyclopentyl-3-(3-methylbutyl)-5-propan-2-ylimidazolidin-4-one (CID 83238286) is 2-cyclopentyl-3-(3-methylbutyl)-5-propan-2-ylimidazolidin-4-one.
What is the SMILES notation for 2-cyclopentyl-3-(3-methylbutyl)-5-propan-2-ylimidazolidin-4-one?
The canonical SMILES for 2-cyclopentyl-3-(3-methylbutyl)-5-propan-2-ylimidazolidin-4-one is CC(C)CCN1C(=O)C(C(C)C)NC1C1CCCC1.
What is the InChIKey of 2-cyclopentyl-3-(3-methylbutyl)-5-propan-2-ylimidazolidin-4-one?
The InChIKey is WSXMEYAZEJMICI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O/c1-11(2)9-10-18-15(13-7-5-6-8-13)17-14(12(3)4)16(18)19/h11-15,17H,5-10H2,1-4H3.
What are the key properties of 2-cyclopentyl-3-(3-methylbutyl)-5-propan-2-ylimidazolidin-4-one?
2-cyclopentyl-3-(3-methylbutyl)-5-propan-2-ylimidazolidin-4-one has a molecular weight of 266.43 g/mol, XLogP of 3.01, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-3-(3-methylbutyl)-5-propan-2-ylimidazolidin-4-one is sourced from PubChem (CID 83238286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).