1-(3-aminocyclopentyl)-3-methylimidazolidin-2-one

C9H17N3O — CID 83817265

IUPAC1-(3-aminocyclopentyl)-3-methylimidazolidin-2-one
SMILESCN1CCN(C2CCC(N)C2)C1=O
InChIInChI=1S/C9H17N3O/c1-11-4-5-12(9(11)13)8-3-2-7(10)6-8/h7-8H,2-6,10H2,1H3
InChIKeyHIWRKSNPCPHGFP-UHFFFAOYSA-N
MW183.25 g/mol
LogP0.23
Rot. Bonds1

About 1-(3-aminocyclopentyl)-3-methylimidazolidin-2-one

1-(3-aminocyclopentyl)-3-methylimidazolidin-2-one (PubChem CID 83817265) has the molecular formula C9H17N3O and a molecular weight of 183.25 g/mol. Its IUPAC name is 1-(3-aminocyclopentyl)-3-methylimidazolidin-2-one.

Molecular Properties

Compound Name1-(3-aminocyclopentyl)-3-methylimidazolidin-2-one
PubChem CID83817265
Molecular FormulaC9H17N3O
Molecular Weight183.25 g/mol
Exact Mass183.14
IUPAC Name1-(3-aminocyclopentyl)-3-methylimidazolidin-2-one
SMILESCN1CCN(C2CCC(N)C2)C1=O
InChIInChI=1S/C9H17N3O/c1-11-4-5-12(9(11)13)8-3-2-7(10)6-8/h7-8H,2-6,10H2,1H3
InChIKeyHIWRKSNPCPHGFP-UHFFFAOYSA-N
XLogP0.23
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 50.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(3-aminocyclopentyl)-3-methylimidazolidin-2-one?
The IUPAC name of 1-(3-aminocyclopentyl)-3-methylimidazolidin-2-one (CID 83817265) is 1-(3-aminocyclopentyl)-3-methylimidazolidin-2-one.
What is the SMILES notation for 1-(3-aminocyclopentyl)-3-methylimidazolidin-2-one?
The canonical SMILES for 1-(3-aminocyclopentyl)-3-methylimidazolidin-2-one is CN1CCN(C2CCC(N)C2)C1=O.
What is the InChIKey of 1-(3-aminocyclopentyl)-3-methylimidazolidin-2-one?
The InChIKey is HIWRKSNPCPHGFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3O/c1-11-4-5-12(9(11)13)8-3-2-7(10)6-8/h7-8H,2-6,10H2,1H3.
What are the key properties of 1-(3-aminocyclopentyl)-3-methylimidazolidin-2-one?
1-(3-aminocyclopentyl)-3-methylimidazolidin-2-one has a molecular weight of 183.25 g/mol, XLogP of 0.23, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-aminocyclopentyl)-3-methylimidazolidin-2-one is sourced from PubChem (CID 83817265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).