1-[2-(1-aminocyclopentyl)phenyl]-3-propan-2-ylimidazolidin-2-one

C17H25N3O — CID 117464112

IUPAC1-[2-(1-aminocyclopentyl)phenyl]-3-propan-2-ylimidazolidin-2-one
SMILESCC(C)N1CCN(c2ccccc2C2(N)CCCC2)C1=O
InChIInChI=1S/C17H25N3O/c1-13(2)19-11-12-20(16(19)21)15-8-4-3-7-14(15)17(18)9-5-6-10-17/h3-4,7-8,13H,5-6,9-12,18H2,1-2H3
InChIKeyWBFLMWOTROGYBB-UHFFFAOYSA-N
MW287.41 g/mol
LogP3.07
Rot. Bonds3

About 1-[2-(1-aminocyclopentyl)phenyl]-3-propan-2-ylimidazolidin-2-one

1-[2-(1-aminocyclopentyl)phenyl]-3-propan-2-ylimidazolidin-2-one (PubChem CID 117464112) has the molecular formula C17H25N3O and a molecular weight of 287.41 g/mol. Its IUPAC name is 1-[2-(1-aminocyclopentyl)phenyl]-3-propan-2-ylimidazolidin-2-one.

Molecular Properties

Compound Name1-[2-(1-aminocyclopentyl)phenyl]-3-propan-2-ylimidazolidin-2-one
PubChem CID117464112
Molecular FormulaC17H25N3O
Molecular Weight287.41 g/mol
Exact Mass287.20
IUPAC Name1-[2-(1-aminocyclopentyl)phenyl]-3-propan-2-ylimidazolidin-2-one
SMILESCC(C)N1CCN(c2ccccc2C2(N)CCCC2)C1=O
InChIInChI=1S/C17H25N3O/c1-13(2)19-11-12-20(16(19)21)15-8-4-3-7-14(15)17(18)9-5-6-10-17/h3-4,7-8,13H,5-6,9-12,18H2,1-2H3
InChIKeyWBFLMWOTROGYBB-UHFFFAOYSA-N
XLogP3.07
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.41
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[2-(1-aminocyclohexyl)phenyl]-3-methylimidazolidin-2-one
CID 117436494
1-[2-(2-aminopropan-2-yl)phenyl]-3-propan-2-ylimidazolidin-2-one
CID 117408491
1-[2-(3-aminopropanoyl)phenyl]-3-propan-2-ylimidazolidin-2-one
CID 117440586
1-[2-(2-aminoacetyl)phenyl]-3-propan-2-ylimidazolidin-2-one
CID 117407698
1-[2-[(E)-3-aminoprop-1-enyl]phenyl]-3-propan-2-ylimidazolidin-2-one
CID 117402443
1-[2-[1-(aminomethyl)cyclobutyl]phenyl]-3-methylimidazolidin-2-one
CID 117402473
1-[3-(2-oxo-3-propan-2-ylimidazolidin-1-yl)phenyl]cyclobutane-1-carboxylic acid
CID 117487167
1-[2-(4,5-dihydroimidazol-1-yl)phenyl]cyclopentan-1-amine
CID 117331093
3-[2-(1-aminocyclopropyl)phenyl]-6,6-dioxo-6λ6-thia-3-azabicyclo[3.1.1]heptan-2-one
CID 84815001
1-[2-[1-(aminomethyl)cyclopentyl]phenyl]-4-methylpiperazine-2,3-dione
CID 117485626
1-[4-(1-aminocyclopentyl)-2,3-dihydroindol-1-yl]ethanone
CID 117362996
1-propan-2-ylspiro[2H-indole-3,3'-piperidine];hydrochloride
CID 70110226

Frequently Asked Questions

What is the IUPAC name of 1-[2-(1-aminocyclopentyl)phenyl]-3-propan-2-ylimidazolidin-2-one?
The IUPAC name of 1-[2-(1-aminocyclopentyl)phenyl]-3-propan-2-ylimidazolidin-2-one (CID 117464112) is 1-[2-(1-aminocyclopentyl)phenyl]-3-propan-2-ylimidazolidin-2-one.
What is the SMILES notation for 1-[2-(1-aminocyclopentyl)phenyl]-3-propan-2-ylimidazolidin-2-one?
The canonical SMILES for 1-[2-(1-aminocyclopentyl)phenyl]-3-propan-2-ylimidazolidin-2-one is CC(C)N1CCN(c2ccccc2C2(N)CCCC2)C1=O.
What is the InChIKey of 1-[2-(1-aminocyclopentyl)phenyl]-3-propan-2-ylimidazolidin-2-one?
The InChIKey is WBFLMWOTROGYBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O/c1-13(2)19-11-12-20(16(19)21)15-8-4-3-7-14(15)17(18)9-5-6-10-17/h3-4,7-8,13H,5-6,9-12,18H2,1-2H3.
What are the key properties of 1-[2-(1-aminocyclopentyl)phenyl]-3-propan-2-ylimidazolidin-2-one?
1-[2-(1-aminocyclopentyl)phenyl]-3-propan-2-ylimidazolidin-2-one has a molecular weight of 287.41 g/mol, XLogP of 3.07, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(1-aminocyclopentyl)phenyl]-3-propan-2-ylimidazolidin-2-one is sourced from PubChem (CID 117464112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).