1-[2-[[2-(aminomethyl)cyclopentyl]methoxy]ethyl]imidazolidin-2-one

C12H23N3O2 — CID 106938474

IUPAC1-[2-[[2-(aminomethyl)cyclopentyl]methoxy]ethyl]imidazolidin-2-one
SMILESNCC1CCCC1COCCN1CCNC1=O
InChIInChI=1S/C12H23N3O2/c13-8-10-2-1-3-11(10)9-17-7-6-15-5-4-14-12(15)16/h10-11H,1-9,13H2,(H,14,16)
InChIKeyUJXMIXNEBKQBJP-UHFFFAOYSA-N
MW241.33 g/mol
LogP0.40
Rot. Bonds6

About 1-[2-[[2-(aminomethyl)cyclopentyl]methoxy]ethyl]imidazolidin-2-one

1-[2-[[2-(aminomethyl)cyclopentyl]methoxy]ethyl]imidazolidin-2-one (PubChem CID 106938474) has the molecular formula C12H23N3O2 and a molecular weight of 241.33 g/mol. Its IUPAC name is 1-[2-[[2-(aminomethyl)cyclopentyl]methoxy]ethyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[2-[[2-(aminomethyl)cyclopentyl]methoxy]ethyl]imidazolidin-2-one
PubChem CID106938474
Molecular FormulaC12H23N3O2
Molecular Weight241.33 g/mol
Exact Mass241.18
IUPAC Name1-[2-[[2-(aminomethyl)cyclopentyl]methoxy]ethyl]imidazolidin-2-one
SMILESNCC1CCCC1COCCN1CCNC1=O
InChIInChI=1S/C12H23N3O2/c13-8-10-2-1-3-11(10)9-17-7-6-15-5-4-14-12(15)16/h10-11H,1-9,13H2,(H,14,16)
InChIKeyUJXMIXNEBKQBJP-UHFFFAOYSA-N
XLogP0.40
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 50.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-[2-[1-(Aminomethyl)cyclopentyl]oxyethyl]imidazolidin-2-one
CID 65050540
1-[2-[[2-(Hydroxymethyl)cyclopentyl]methylamino]ethyl]imidazolidin-2-one
CID 65927465
1-[2-(2-Piperidin-3-ylethoxy)ethyl]imidazolidin-2-one
CID 106938128
1-[2-[(1-Aminocyclopentyl)methoxy]ethyl]imidazolidin-2-one
CID 106938219
1-[2-[2-(Aminomethyl)cyclopentyl]oxyethyl]imidazolidin-2-one
CID 106938383
1-[2-[[2-(Aminomethyl)cyclohexyl]methoxy]ethyl]imidazolidin-2-one
CID 106938440
1-[2-[(1-Aminocyclohexyl)methoxy]ethyl]imidazolidin-2-one
CID 113895251
1-[2-[2-(Aminomethyl)cyclohexyl]oxyethyl]imidazolidin-2-one
CID 113895273
1-[[2-(Hydroxymethyl)cyclopentyl]methyl]imidazolidin-2-one
CID 115370743

Frequently Asked Questions

What is the IUPAC name of 1-[2-[[2-(aminomethyl)cyclopentyl]methoxy]ethyl]imidazolidin-2-one?
The IUPAC name of 1-[2-[[2-(aminomethyl)cyclopentyl]methoxy]ethyl]imidazolidin-2-one (CID 106938474) is 1-[2-[[2-(aminomethyl)cyclopentyl]methoxy]ethyl]imidazolidin-2-one.
What is the SMILES notation for 1-[2-[[2-(aminomethyl)cyclopentyl]methoxy]ethyl]imidazolidin-2-one?
The canonical SMILES for 1-[2-[[2-(aminomethyl)cyclopentyl]methoxy]ethyl]imidazolidin-2-one is NCC1CCCC1COCCN1CCNC1=O.
What is the InChIKey of 1-[2-[[2-(aminomethyl)cyclopentyl]methoxy]ethyl]imidazolidin-2-one?
The InChIKey is UJXMIXNEBKQBJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O2/c13-8-10-2-1-3-11(10)9-17-7-6-15-5-4-14-12(15)16/h10-11H,1-9,13H2,(H,14,16).
What are the key properties of 1-[2-[[2-(aminomethyl)cyclopentyl]methoxy]ethyl]imidazolidin-2-one?
1-[2-[[2-(aminomethyl)cyclopentyl]methoxy]ethyl]imidazolidin-2-one has a molecular weight of 241.33 g/mol, XLogP of 0.40, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[[2-(aminomethyl)cyclopentyl]methoxy]ethyl]imidazolidin-2-one is sourced from PubChem (CID 106938474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).