1-(2-morpholin-4-ylethyl)-4,5-di(propan-2-yl)imidazolidin-2-one

C15H29N3O2 — CID 123148339

IUPAC1-(2-morpholin-4-ylethyl)-4,5-di(propan-2-yl)imidazolidin-2-one
SMILESCC(C)C1NC(=O)N(CCN2CCOCC2)C1C(C)C
InChIInChI=1S/C15H29N3O2/c1-11(2)13-14(12(3)4)18(15(19)16-13)6-5-17-7-9-20-10-8-17/h11-14H,5-10H2,1-4H3,(H,16,19)
InChIKeyMXPJVUAAUYFJHC-UHFFFAOYSA-N
MW283.42 g/mol
LogP1.39
Rot. Bonds5

About 1-(2-morpholin-4-ylethyl)-4,5-di(propan-2-yl)imidazolidin-2-one

1-(2-morpholin-4-ylethyl)-4,5-di(propan-2-yl)imidazolidin-2-one (PubChem CID 123148339) has the molecular formula C15H29N3O2 and a molecular weight of 283.42 g/mol. Its IUPAC name is 1-(2-morpholin-4-ylethyl)-4,5-di(propan-2-yl)imidazolidin-2-one.

Molecular Properties

Compound Name1-(2-morpholin-4-ylethyl)-4,5-di(propan-2-yl)imidazolidin-2-one
PubChem CID123148339
Molecular FormulaC15H29N3O2
Molecular Weight283.42 g/mol
Exact Mass283.23
IUPAC Name1-(2-morpholin-4-ylethyl)-4,5-di(propan-2-yl)imidazolidin-2-one
SMILESCC(C)C1NC(=O)N(CCN2CCOCC2)C1C(C)C
InChIInChI=1S/C15H29N3O2/c1-11(2)13-14(12(3)4)18(15(19)16-13)6-5-17-7-9-20-10-8-17/h11-14H,5-10H2,1-4H3,(H,16,19)
InChIKeyMXPJVUAAUYFJHC-UHFFFAOYSA-N
XLogP1.39
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2-morpholin-4-ylethyl)-4,5-di(propan-2-yl)imidazolidin-2-one?
The IUPAC name of 1-(2-morpholin-4-ylethyl)-4,5-di(propan-2-yl)imidazolidin-2-one (CID 123148339) is 1-(2-morpholin-4-ylethyl)-4,5-di(propan-2-yl)imidazolidin-2-one.
What is the SMILES notation for 1-(2-morpholin-4-ylethyl)-4,5-di(propan-2-yl)imidazolidin-2-one?
The canonical SMILES for 1-(2-morpholin-4-ylethyl)-4,5-di(propan-2-yl)imidazolidin-2-one is CC(C)C1NC(=O)N(CCN2CCOCC2)C1C(C)C.
What is the InChIKey of 1-(2-morpholin-4-ylethyl)-4,5-di(propan-2-yl)imidazolidin-2-one?
The InChIKey is MXPJVUAAUYFJHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O2/c1-11(2)13-14(12(3)4)18(15(19)16-13)6-5-17-7-9-20-10-8-17/h11-14H,5-10H2,1-4H3,(H,16,19).
What are the key properties of 1-(2-morpholin-4-ylethyl)-4,5-di(propan-2-yl)imidazolidin-2-one?
1-(2-morpholin-4-ylethyl)-4,5-di(propan-2-yl)imidazolidin-2-one has a molecular weight of 283.42 g/mol, XLogP of 1.39, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-morpholin-4-ylethyl)-4,5-di(propan-2-yl)imidazolidin-2-one is sourced from PubChem (CID 123148339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).