4-pyrrolidin-1-yl-1,5-dihydroimidazol-2-one

C7H11N3O — CID 533478

IUPAC4-pyrrolidin-1-yl-1,5-dihydroimidazol-2-one
SMILESO=C1N=C(N2CCCC2)CN1
InChIInChI=1S/C7H11N3O/c11-7-8-5-6(9-7)10-3-1-2-4-10/h1-5H2,(H,8,11)
InChIKeyDFRHDNUNKYGVOY-UHFFFAOYSA-N
MW153.19 g/mol
LogP0.20
Rot. Bonds

About 4-pyrrolidin-1-yl-1,5-dihydroimidazol-2-one

4-pyrrolidin-1-yl-1,5-dihydroimidazol-2-one (PubChem CID 533478) has the molecular formula C7H11N3O and a molecular weight of 153.19 g/mol. Its IUPAC name is 4-pyrrolidin-1-yl-1,5-dihydroimidazol-2-one.

Molecular Properties

Compound Name4-pyrrolidin-1-yl-1,5-dihydroimidazol-2-one
PubChem CID533478
Molecular FormulaC7H11N3O
Molecular Weight153.19 g/mol
Exact Mass153.09
IUPAC Name4-pyrrolidin-1-yl-1,5-dihydroimidazol-2-one
SMILESO=C1N=C(N2CCCC2)CN1
InChIInChI=1S/C7H11N3O/c11-7-8-5-6(9-7)10-3-1-2-4-10/h1-5H2,(H,8,11)
InChIKeyDFRHDNUNKYGVOY-UHFFFAOYSA-N
XLogP0.20
TPSA44.70 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.19
LogP ≤ 50.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(4,5-dihydro-1H-imidazol-2-yl)propylurea
CID 69597469
N-Methyl-N'-(1-methylpyrrolidin-2-ylidene)urea
CID 71430352
2-(2-Iminopyrrolidin-1-yl)ethylurea
CID 83112868
2-(3,4-dihydro-2H-pyrrol-5-ylamino)ethylurea
CID 83120369
1-(C,N-dimethylcarbonimidoyl)imidazolidin-2-one
CID 145372236

Frequently Asked Questions

What is the IUPAC name of 4-pyrrolidin-1-yl-1,5-dihydroimidazol-2-one?
The IUPAC name of 4-pyrrolidin-1-yl-1,5-dihydroimidazol-2-one (CID 533478) is 4-pyrrolidin-1-yl-1,5-dihydroimidazol-2-one.
What is the SMILES notation for 4-pyrrolidin-1-yl-1,5-dihydroimidazol-2-one?
The canonical SMILES for 4-pyrrolidin-1-yl-1,5-dihydroimidazol-2-one is O=C1N=C(N2CCCC2)CN1.
What is the InChIKey of 4-pyrrolidin-1-yl-1,5-dihydroimidazol-2-one?
The InChIKey is DFRHDNUNKYGVOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O/c11-7-8-5-6(9-7)10-3-1-2-4-10/h1-5H2,(H,8,11).
What are the key properties of 4-pyrrolidin-1-yl-1,5-dihydroimidazol-2-one?
4-pyrrolidin-1-yl-1,5-dihydroimidazol-2-one has a molecular weight of 153.19 g/mol, XLogP of 0.20, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-pyrrolidin-1-yl-1,5-dihydroimidazol-2-one is sourced from PubChem (CID 533478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).