4-(2-pyrrolidin-2-ylpyrrolidine-1-carbonyl)-1,3-dihydroimidazol-2-one

C12H18N4O2 — CID 62275240

IUPAC4-(2-pyrrolidin-2-ylpyrrolidine-1-carbonyl)-1,3-dihydroimidazol-2-one
SMILESO=C(c1c[nH]c(=O)[nH]1)N1CCCC1C1CCCN1
InChIInChI=1S/C12H18N4O2/c17-11(9-7-14-12(18)15-9)16-6-2-4-10(16)8-3-1-5-13-8/h7-8,10,13H,1-6H2,(H2,14,15,18)
InChIKeySZZPUANTTREVLA-UHFFFAOYSA-N
MW250.30 g/mol
LogP0.06
Rot. Bonds2

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

4-(2-pyrrolidin-2-ylpyrrolidine-1-carbonyl)-1,3-dihydroimidazol-2-one (PubChem CID 62275240) has the molecular formula C12H18N4O2 and a molecular weight of 250.30 g/mol. Its IUPAC name is 4-(2-pyrrolidin-2-ylpyrrolidine-1-carbonyl)-1,3-dihydroimidazol-2-one.

Molecular Properties

Compound Name4-(2-pyrrolidin-2-ylpyrrolidine-1-carbonyl)-1,3-dihydroimidazol-2-one
PubChem CID62275240
Molecular FormulaC12H18N4O2
Molecular Weight250.30 g/mol
Exact Mass250.14
IUPAC Name4-(2-pyrrolidin-2-ylpyrrolidine-1-carbonyl)-1,3-dihydroimidazol-2-one
SMILESO=C(c1c[nH]c(=O)[nH]1)N1CCCC1C1CCCN1
InChIInChI=1S/C12H18N4O2/c17-11(9-7-14-12(18)15-9)16-6-2-4-10(16)8-3-1-5-13-8/h7-8,10,13H,1-6H2,(H2,14,15,18)
InChIKeySZZPUANTTREVLA-UHFFFAOYSA-N
XLogP0.06
TPSA80.99 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 50.06
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(2-pyrrolidin-2-ylpyrrolidine-1-carbonyl)-1,3-dihydroimidazol-2-one?
The IUPAC name of 4-(2-pyrrolidin-2-ylpyrrolidine-1-carbonyl)-1,3-dihydroimidazol-2-one (CID 62275240) is 4-(2-pyrrolidin-2-ylpyrrolidine-1-carbonyl)-1,3-dihydroimidazol-2-one.
What is the SMILES notation for 4-(2-pyrrolidin-2-ylpyrrolidine-1-carbonyl)-1,3-dihydroimidazol-2-one?
The canonical SMILES for 4-(2-pyrrolidin-2-ylpyrrolidine-1-carbonyl)-1,3-dihydroimidazol-2-one is O=C(c1c[nH]c(=O)[nH]1)N1CCCC1C1CCCN1.
What is the InChIKey of 4-(2-pyrrolidin-2-ylpyrrolidine-1-carbonyl)-1,3-dihydroimidazol-2-one?
The InChIKey is SZZPUANTTREVLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O2/c17-11(9-7-14-12(18)15-9)16-6-2-4-10(16)8-3-1-5-13-8/h7-8,10,13H,1-6H2,(H2,14,15,18).
What are the key properties of 4-(2-pyrrolidin-2-ylpyrrolidine-1-carbonyl)-1,3-dihydroimidazol-2-one?
4-(2-pyrrolidin-2-ylpyrrolidine-1-carbonyl)-1,3-dihydroimidazol-2-one has a molecular weight of 250.30 g/mol, XLogP of 0.06, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-pyrrolidin-2-ylpyrrolidine-1-carbonyl)-1,3-dihydroimidazol-2-one is sourced from PubChem (CID 62275240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).