1,3-dihydroindol-2-one;imidazolidin-2-one

C11H13N3O2 — CID 70182850

IUPAC1,3-dihydroindol-2-one;imidazolidin-2-one
SMILESO=C1Cc2ccccc2N1.O=C1NCCN1
InChIInChI=1S/C8H7NO.C3H6N2O/c10-8-5-6-3-1-2-4-7(6)9-8;6-3-4-1-2-5-3/h1-4H,5H2,(H,9,10);1-2H2,(H2,4,5,6)
InChIKeyZWRUUAWQUGBMBY-UHFFFAOYSA-N
MW219.24 g/mol
LogP0.48
Rot. Bonds

About 1,3-dihydroindol-2-one;imidazolidin-2-one

1,3-dihydroindol-2-one;imidazolidin-2-one (PubChem CID 70182850) has the molecular formula C11H13N3O2 and a molecular weight of 219.24 g/mol. Its IUPAC name is 1,3-dihydroindol-2-one;imidazolidin-2-one.

Molecular Properties

Compound Name1,3-dihydroindol-2-one;imidazolidin-2-one
PubChem CID70182850
Molecular FormulaC11H13N3O2
Molecular Weight219.24 g/mol
Exact Mass219.10
IUPAC Name1,3-dihydroindol-2-one;imidazolidin-2-one
SMILESO=C1Cc2ccccc2N1.O=C1NCCN1
InChIInChI=1S/C8H7NO.C3H6N2O/c10-8-5-6-3-1-2-4-7(6)9-8;6-3-4-1-2-5-3/h1-4H,5H2,(H,9,10);1-2H2,(H2,4,5,6)
InChIKeyZWRUUAWQUGBMBY-UHFFFAOYSA-N
XLogP0.48
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.24
LogP ≤ 50.48
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

1,3-dihydroindol-2-one;trihydrochloride
CID 66960013
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CID 160648154
acetic acid;1,3-dihydroindol-2-one
CID 158067424
1,3-dihydroindol-2-one;pyrrolo[3,2-b]pyrrole
CID 175423185
1,3-dihydroindol-2-one;1,2-dimethylimidazole
CID 143871997
9,10-dihydroacridine
CID 137366999
10,12-dihydrobenzo[b][1,6]benzothiazocin-11-one
CID 13112891
1,2,3,5,6,7-hexahydro-3,5-benzodiazonin-4-one
CID 22722283
1,3-dihydroindol-2-one;2-hydroxybutanedioic acid
CID 66903255
3,4-dihydro-1H-quinolin-2-one;ethane
CID 90913605
6-phenyl-1,3-dihydroindol-2-one
CID 10536384

Frequently Asked Questions

What is the IUPAC name of 1,3-dihydroindol-2-one;imidazolidin-2-one?
The IUPAC name of 1,3-dihydroindol-2-one;imidazolidin-2-one (CID 70182850) is 1,3-dihydroindol-2-one;imidazolidin-2-one.
What is the SMILES notation for 1,3-dihydroindol-2-one;imidazolidin-2-one?
The canonical SMILES for 1,3-dihydroindol-2-one;imidazolidin-2-one is O=C1Cc2ccccc2N1.O=C1NCCN1.
What is the InChIKey of 1,3-dihydroindol-2-one;imidazolidin-2-one?
The InChIKey is ZWRUUAWQUGBMBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7NO.C3H6N2O/c10-8-5-6-3-1-2-4-7(6)9-8;6-3-4-1-2-5-3/h1-4H,5H2,(H,9,10);1-2H2,(H2,4,5,6).
What are the key properties of 1,3-dihydroindol-2-one;imidazolidin-2-one?
1,3-dihydroindol-2-one;imidazolidin-2-one has a molecular weight of 219.24 g/mol, XLogP of 0.48, 0 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dihydroindol-2-one;imidazolidin-2-one is sourced from PubChem (CID 70182850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).