1-[2-[1-(aminomethyl)-3-methylcyclopentyl]oxyethyl]imidazolidin-2-one

C12H23N3O2 — CID 65051842

IUPAC1-[2-[1-(aminomethyl)-3-methylcyclopentyl]oxyethyl]imidazolidin-2-one
SMILESCC1CCC(CN)(OCCN2CCNC2=O)C1
InChIInChI=1S/C12H23N3O2/c1-10-2-3-12(8-10,9-13)17-7-6-15-5-4-14-11(15)16/h10H,2-9,13H2,1H3,(H,14,16)
InChIKeyUXRBHCKDTQXFLL-UHFFFAOYSA-N
MW241.33 g/mol
LogP0.55
Rot. Bonds5

About 1-[2-[1-(aminomethyl)-3-methylcyclopentyl]oxyethyl]imidazolidin-2-one

1-[2-[1-(aminomethyl)-3-methylcyclopentyl]oxyethyl]imidazolidin-2-one (PubChem CID 65051842) has the molecular formula C12H23N3O2 and a molecular weight of 241.33 g/mol. Its IUPAC name is 1-[2-[1-(aminomethyl)-3-methylcyclopentyl]oxyethyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[2-[1-(aminomethyl)-3-methylcyclopentyl]oxyethyl]imidazolidin-2-one
PubChem CID65051842
Molecular FormulaC12H23N3O2
Molecular Weight241.33 g/mol
Exact Mass241.18
IUPAC Name1-[2-[1-(aminomethyl)-3-methylcyclopentyl]oxyethyl]imidazolidin-2-one
SMILESCC1CCC(CN)(OCCN2CCNC2=O)C1
InChIInChI=1S/C12H23N3O2/c1-10-2-3-12(8-10,9-13)17-7-6-15-5-4-14-11(15)16/h10H,2-9,13H2,1H3,(H,14,16)
InChIKeyUXRBHCKDTQXFLL-UHFFFAOYSA-N
XLogP0.55
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 50.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[2-[1-(aminomethyl)-3-methylcyclopentyl]oxyethyl]imidazolidin-2-one?
The IUPAC name of 1-[2-[1-(aminomethyl)-3-methylcyclopentyl]oxyethyl]imidazolidin-2-one (CID 65051842) is 1-[2-[1-(aminomethyl)-3-methylcyclopentyl]oxyethyl]imidazolidin-2-one.
What is the SMILES notation for 1-[2-[1-(aminomethyl)-3-methylcyclopentyl]oxyethyl]imidazolidin-2-one?
The canonical SMILES for 1-[2-[1-(aminomethyl)-3-methylcyclopentyl]oxyethyl]imidazolidin-2-one is CC1CCC(CN)(OCCN2CCNC2=O)C1.
What is the InChIKey of 1-[2-[1-(aminomethyl)-3-methylcyclopentyl]oxyethyl]imidazolidin-2-one?
The InChIKey is UXRBHCKDTQXFLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O2/c1-10-2-3-12(8-10,9-13)17-7-6-15-5-4-14-11(15)16/h10H,2-9,13H2,1H3,(H,14,16).
What are the key properties of 1-[2-[1-(aminomethyl)-3-methylcyclopentyl]oxyethyl]imidazolidin-2-one?
1-[2-[1-(aminomethyl)-3-methylcyclopentyl]oxyethyl]imidazolidin-2-one has a molecular weight of 241.33 g/mol, XLogP of 0.55, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[1-(aminomethyl)-3-methylcyclopentyl]oxyethyl]imidazolidin-2-one is sourced from PubChem (CID 65051842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).