1-(3-pyrimidin-4-yloxypiperidine-1-carbonyl)imidazolidin-2-one

C13H17N5O3 — CID 122161089

IUPAC1-(3-pyrimidin-4-yloxypiperidine-1-carbonyl)imidazolidin-2-one
SMILESO=C1NCCN1C(=O)N1CCCC(Oc2ccncn2)C1
InChIInChI=1S/C13H17N5O3/c19-12-15-5-7-18(12)13(20)17-6-1-2-10(8-17)21-11-3-4-14-9-16-11/h3-4,9-10H,1-2,5-8H2,(H,15,19)
InChIKeyJPAKIVGOSBBTSJ-UHFFFAOYSA-N
MW291.31 g/mol
LogP0.47
Rot. Bonds2

About 1-(3-pyrimidin-4-yloxypiperidine-1-carbonyl)imidazolidin-2-one

1-(3-pyrimidin-4-yloxypiperidine-1-carbonyl)imidazolidin-2-one (PubChem CID 122161089) has the molecular formula C13H17N5O3 and a molecular weight of 291.31 g/mol. Its IUPAC name is 1-(3-pyrimidin-4-yloxypiperidine-1-carbonyl)imidazolidin-2-one.

Molecular Properties

Compound Name1-(3-pyrimidin-4-yloxypiperidine-1-carbonyl)imidazolidin-2-one
PubChem CID122161089
Molecular FormulaC13H17N5O3
Molecular Weight291.31 g/mol
Exact Mass291.13
IUPAC Name1-(3-pyrimidin-4-yloxypiperidine-1-carbonyl)imidazolidin-2-one
SMILESO=C1NCCN1C(=O)N1CCCC(Oc2ccncn2)C1
InChIInChI=1S/C13H17N5O3/c19-12-15-5-7-18(12)13(20)17-6-1-2-10(8-17)21-11-3-4-14-9-16-11/h3-4,9-10H,1-2,5-8H2,(H,15,19)
InChIKeyJPAKIVGOSBBTSJ-UHFFFAOYSA-N
XLogP0.47
TPSA87.66 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.31
LogP ≤ 50.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[(3S)-3-pyrazin-2-yloxypiperidine-1-carbonyl]imidazolidin-2-one
CID 100647916
N-ethyl-3-pyrimidin-4-yloxypiperidine-1-carboxamide
CID 122260044
2-cyclohexyl-1-(3-pyrimidin-4-yloxypiperidin-1-yl)ethanone
CID 122259749
1-[3-(5-ethylpyrimidin-2-yl)oxypiperidine-1-carbonyl]imidazolidin-2-one
CID 122268349
2,2-diphenyl-1-(3-pyrimidin-4-yloxypiperidin-1-yl)ethanone
CID 122161054
N-propyl-3-pyrimidin-4-yloxypiperidine-1-carboxamide
CID 122260053
3-chloro-2,2-dimethyl-1-(3-pyrimidin-4-yloxypiperidin-1-yl)propan-1-one
CID 122259763
(2-methylphenyl)-(3-pyrimidin-4-yloxypiperidin-1-yl)methanone
CID 122259764
N-(2-methoxyethyl)-3-pyrimidin-4-yloxypiperidine-1-carboxamide
CID 122260046
1-[3-oxo-3-(3-pyrimidin-4-yloxypiperidin-1-yl)propyl]pyrimidine-2,4-dione
CID 122160256
(3-pyrimidin-4-yloxypiperidin-1-yl)-(3,4,5-trimethoxyphenyl)methanone
CID 122259782
1-[(3S)-3-[[4-(trifluoromethyl)-2-pyridinyl]oxy]pyrrolidine-1-carbonyl]imidazolidin-2-one
CID 100738977

Frequently Asked Questions

What is the IUPAC name of 1-(3-pyrimidin-4-yloxypiperidine-1-carbonyl)imidazolidin-2-one?
The IUPAC name of 1-(3-pyrimidin-4-yloxypiperidine-1-carbonyl)imidazolidin-2-one (CID 122161089) is 1-(3-pyrimidin-4-yloxypiperidine-1-carbonyl)imidazolidin-2-one.
What is the SMILES notation for 1-(3-pyrimidin-4-yloxypiperidine-1-carbonyl)imidazolidin-2-one?
The canonical SMILES for 1-(3-pyrimidin-4-yloxypiperidine-1-carbonyl)imidazolidin-2-one is O=C1NCCN1C(=O)N1CCCC(Oc2ccncn2)C1.
What is the InChIKey of 1-(3-pyrimidin-4-yloxypiperidine-1-carbonyl)imidazolidin-2-one?
The InChIKey is JPAKIVGOSBBTSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5O3/c19-12-15-5-7-18(12)13(20)17-6-1-2-10(8-17)21-11-3-4-14-9-16-11/h3-4,9-10H,1-2,5-8H2,(H,15,19).
What are the key properties of 1-(3-pyrimidin-4-yloxypiperidine-1-carbonyl)imidazolidin-2-one?
1-(3-pyrimidin-4-yloxypiperidine-1-carbonyl)imidazolidin-2-one has a molecular weight of 291.31 g/mol, XLogP of 0.47, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-pyrimidin-4-yloxypiperidine-1-carbonyl)imidazolidin-2-one is sourced from PubChem (CID 122161089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).