1-[2-[(2-ethylcyclohexyl)amino]ethyl]imidazolidin-2-one

C13H25N3O — CID 54955331

IUPAC1-[2-[(2-ethylcyclohexyl)amino]ethyl]imidazolidin-2-one
SMILESCCC1CCCCC1NCCN1CCNC1=O
InChIInChI=1S/C13H25N3O/c1-2-11-5-3-4-6-12(11)14-7-9-16-10-8-15-13(16)17/h11-12,14H,2-10H2,1H3,(H,15,17)
InChIKeyUSZPVNHIXVPOFM-UHFFFAOYSA-N
MW239.36 g/mol
LogP1.57
Rot. Bonds5

About 1-[2-[(2-ethylcyclohexyl)amino]ethyl]imidazolidin-2-one

1-[2-[(2-ethylcyclohexyl)amino]ethyl]imidazolidin-2-one (PubChem CID 54955331) has the molecular formula C13H25N3O and a molecular weight of 239.36 g/mol. Its IUPAC name is 1-[2-[(2-ethylcyclohexyl)amino]ethyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[2-[(2-ethylcyclohexyl)amino]ethyl]imidazolidin-2-one
PubChem CID54955331
Molecular FormulaC13H25N3O
Molecular Weight239.36 g/mol
Exact Mass239.20
IUPAC Name1-[2-[(2-ethylcyclohexyl)amino]ethyl]imidazolidin-2-one
SMILESCCC1CCCCC1NCCN1CCNC1=O
InChIInChI=1S/C13H25N3O/c1-2-11-5-3-4-6-12(11)14-7-9-16-10-8-15-13(16)17/h11-12,14H,2-10H2,1H3,(H,15,17)
InChIKeyUSZPVNHIXVPOFM-UHFFFAOYSA-N
XLogP1.57
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[2-[(2-ethylcyclohexyl)amino]ethyl]imidazolidin-2-one?
The IUPAC name of 1-[2-[(2-ethylcyclohexyl)amino]ethyl]imidazolidin-2-one (CID 54955331) is 1-[2-[(2-ethylcyclohexyl)amino]ethyl]imidazolidin-2-one.
What is the SMILES notation for 1-[2-[(2-ethylcyclohexyl)amino]ethyl]imidazolidin-2-one?
The canonical SMILES for 1-[2-[(2-ethylcyclohexyl)amino]ethyl]imidazolidin-2-one is CCC1CCCCC1NCCN1CCNC1=O.
What is the InChIKey of 1-[2-[(2-ethylcyclohexyl)amino]ethyl]imidazolidin-2-one?
The InChIKey is USZPVNHIXVPOFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O/c1-2-11-5-3-4-6-12(11)14-7-9-16-10-8-15-13(16)17/h11-12,14H,2-10H2,1H3,(H,15,17).
What are the key properties of 1-[2-[(2-ethylcyclohexyl)amino]ethyl]imidazolidin-2-one?
1-[2-[(2-ethylcyclohexyl)amino]ethyl]imidazolidin-2-one has a molecular weight of 239.36 g/mol, XLogP of 1.57, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[(2-ethylcyclohexyl)amino]ethyl]imidazolidin-2-one is sourced from PubChem (CID 54955331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).