4-(piperazine-1-carbonyl)-1,3-dihydroimidazol-2-one

C8H12N4O2 — CID 28788613

IUPAC4-(piperazine-1-carbonyl)-1,3-dihydroimidazol-2-one
SMILESO=C(c1c[nH]c(=O)[nH]1)N1CCNCC1
InChIInChI=1S/C8H12N4O2/c13-7(6-5-10-8(14)11-6)12-3-1-9-2-4-12/h5,9H,1-4H2,(H2,10,11,14)
InChIKeyGYQUWAASFPLFRT-UHFFFAOYSA-N
MW196.21 g/mol
LogP-1.25
Rot. Bonds1

About 4-(piperazine-1-carbonyl)-1,3-dihydroimidazol-2-one

4-(piperazine-1-carbonyl)-1,3-dihydroimidazol-2-one (PubChem CID 28788613) has the molecular formula C8H12N4O2 and a molecular weight of 196.21 g/mol. Its IUPAC name is 4-(piperazine-1-carbonyl)-1,3-dihydroimidazol-2-one.

Molecular Properties

Compound Name4-(piperazine-1-carbonyl)-1,3-dihydroimidazol-2-one
PubChem CID28788613
Molecular FormulaC8H12N4O2
Molecular Weight196.21 g/mol
Exact Mass196.10
IUPAC Name4-(piperazine-1-carbonyl)-1,3-dihydroimidazol-2-one
SMILESO=C(c1c[nH]c(=O)[nH]1)N1CCNCC1
InChIInChI=1S/C8H12N4O2/c13-7(6-5-10-8(14)11-6)12-3-1-9-2-4-12/h5,9H,1-4H2,(H2,10,11,14)
InChIKeyGYQUWAASFPLFRT-UHFFFAOYSA-N
XLogP-1.25
TPSA80.99 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.21
LogP ≤ 5-1.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(piperazine-1-carbonyl)-1,3-dihydroimidazol-2-one?
The IUPAC name of 4-(piperazine-1-carbonyl)-1,3-dihydroimidazol-2-one (CID 28788613) is 4-(piperazine-1-carbonyl)-1,3-dihydroimidazol-2-one.
What is the SMILES notation for 4-(piperazine-1-carbonyl)-1,3-dihydroimidazol-2-one?
The canonical SMILES for 4-(piperazine-1-carbonyl)-1,3-dihydroimidazol-2-one is O=C(c1c[nH]c(=O)[nH]1)N1CCNCC1.
What is the InChIKey of 4-(piperazine-1-carbonyl)-1,3-dihydroimidazol-2-one?
The InChIKey is GYQUWAASFPLFRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N4O2/c13-7(6-5-10-8(14)11-6)12-3-1-9-2-4-12/h5,9H,1-4H2,(H2,10,11,14).
What are the key properties of 4-(piperazine-1-carbonyl)-1,3-dihydroimidazol-2-one?
4-(piperazine-1-carbonyl)-1,3-dihydroimidazol-2-one has a molecular weight of 196.21 g/mol, XLogP of -1.25, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(piperazine-1-carbonyl)-1,3-dihydroimidazol-2-one is sourced from PubChem (CID 28788613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).