4-[2-(hydroxymethyl)piperidine-1-carbonyl]-1,3-dihydroimidazol-2-one

C10H15N3O3 — CID 43572820

IUPAC4-[2-(hydroxymethyl)piperidine-1-carbonyl]-1,3-dihydroimidazol-2-one
SMILESO=C(c1c[nH]c(=O)[nH]1)N1CCCCC1CO
InChIInChI=1S/C10H15N3O3/c14-6-7-3-1-2-4-13(7)9(15)8-5-11-10(16)12-8/h5,7,14H,1-4,6H2,(H2,11,12,16)
InChIKeyWRCXZBBTKAVTAE-UHFFFAOYSA-N
MW225.25 g/mol
LogP-0.31
Rot. Bonds2

About 4-[2-(hydroxymethyl)piperidine-1-carbonyl]-1,3-dihydroimidazol-2-one

4-[2-(hydroxymethyl)piperidine-1-carbonyl]-1,3-dihydroimidazol-2-one (PubChem CID 43572820) has the molecular formula C10H15N3O3 and a molecular weight of 225.25 g/mol. Its IUPAC name is 4-[2-(hydroxymethyl)piperidine-1-carbonyl]-1,3-dihydroimidazol-2-one.

Molecular Properties

Compound Name4-[2-(hydroxymethyl)piperidine-1-carbonyl]-1,3-dihydroimidazol-2-one
PubChem CID43572820
Molecular FormulaC10H15N3O3
Molecular Weight225.25 g/mol
Exact Mass225.11
IUPAC Name4-[2-(hydroxymethyl)piperidine-1-carbonyl]-1,3-dihydroimidazol-2-one
SMILESO=C(c1c[nH]c(=O)[nH]1)N1CCCCC1CO
InChIInChI=1S/C10H15N3O3/c14-6-7-3-1-2-4-13(7)9(15)8-5-11-10(16)12-8/h5,7,14H,1-4,6H2,(H2,11,12,16)
InChIKeyWRCXZBBTKAVTAE-UHFFFAOYSA-N
XLogP-0.31
TPSA89.19 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 5-0.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-1-(2-oxo-1,3-dihydroimidazole-4-carbonyl)piperidine-2-carboxylic acid
CID 28789966
(2R)-1-(2-oxo-1,3-dihydroimidazole-4-carbonyl)piperidine-2-carboxylic acid
CID 28789969
1-(2-Oxo-1,3-dihydroimidazole-4-carbonyl)piperidine-2-carboxylic acid
CID 43211121
N-(4-hydroxycyclohexyl)-2-oxo-1,3-dihydroimidazole-4-carboxamide
CID 43392584
1-[2-[2-(Hydroxymethyl)piperidin-1-yl]-2-oxoethyl]pyrimidine-2,4-dione
CID 43421235
4-(4-Hydroxypiperidine-1-carbonyl)-1,3-dihydroimidazol-2-one
CID 43502628
4-(3-Hydroxypiperidine-1-carbonyl)-1,3-dihydroimidazol-2-one
CID 43502670
6-[2-(hydroxymethyl)piperidine-1-carbonyl]-1H-pyrimidine-2,4-dione
CID 43572844
4-[3-(Hydroxymethyl)piperidine-1-carbonyl]-1,3-dihydroimidazol-2-one
CID 43589499
4-[2-(2-Hydroxyethyl)piperidine-1-carbonyl]-1,3-dihydroimidazol-2-one
CID 54878389
N-cyclohexyl-N-(2-hydroxyethyl)-2-oxo-1,3-dihydroimidazole-4-carboxamide
CID 54979358
N-cyclopentyl-N-(2-hydroxyethyl)-2-oxo-1,3-dihydroimidazole-4-carboxamide
CID 54999274

Frequently Asked Questions

What is the IUPAC name of 4-[2-(hydroxymethyl)piperidine-1-carbonyl]-1,3-dihydroimidazol-2-one?
The IUPAC name of 4-[2-(hydroxymethyl)piperidine-1-carbonyl]-1,3-dihydroimidazol-2-one (CID 43572820) is 4-[2-(hydroxymethyl)piperidine-1-carbonyl]-1,3-dihydroimidazol-2-one.
What is the SMILES notation for 4-[2-(hydroxymethyl)piperidine-1-carbonyl]-1,3-dihydroimidazol-2-one?
The canonical SMILES for 4-[2-(hydroxymethyl)piperidine-1-carbonyl]-1,3-dihydroimidazol-2-one is O=C(c1c[nH]c(=O)[nH]1)N1CCCCC1CO.
What is the InChIKey of 4-[2-(hydroxymethyl)piperidine-1-carbonyl]-1,3-dihydroimidazol-2-one?
The InChIKey is WRCXZBBTKAVTAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O3/c14-6-7-3-1-2-4-13(7)9(15)8-5-11-10(16)12-8/h5,7,14H,1-4,6H2,(H2,11,12,16).
What are the key properties of 4-[2-(hydroxymethyl)piperidine-1-carbonyl]-1,3-dihydroimidazol-2-one?
4-[2-(hydroxymethyl)piperidine-1-carbonyl]-1,3-dihydroimidazol-2-one has a molecular weight of 225.25 g/mol, XLogP of -0.31, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(hydroxymethyl)piperidine-1-carbonyl]-1,3-dihydroimidazol-2-one is sourced from PubChem (CID 43572820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).