1-[1-(cyclohexanecarbonyl)pyrrolidine-2-carbonyl]imidazolidin-4-one

C15H23N3O3 — CID 46994600

IUPAC1-[1-(cyclohexanecarbonyl)pyrrolidine-2-carbonyl]imidazolidin-4-one
SMILESO=C1CN(C(=O)C2CCCN2C(=O)C2CCCCC2)CN1
InChIInChI=1S/C15H23N3O3/c19-13-9-17(10-16-13)15(21)12-7-4-8-18(12)14(20)11-5-2-1-3-6-11/h11-12H,1-10H2,(H,16,19)
InChIKeyCCGZAXLWGIMTSA-UHFFFAOYSA-N
MW293.37 g/mol
LogP0.47
Rot. Bonds2

About 1-[1-(cyclohexanecarbonyl)pyrrolidine-2-carbonyl]imidazolidin-4-one

1-[1-(cyclohexanecarbonyl)pyrrolidine-2-carbonyl]imidazolidin-4-one (PubChem CID 46994600) has the molecular formula C15H23N3O3 and a molecular weight of 293.37 g/mol. Its IUPAC name is 1-[1-(cyclohexanecarbonyl)pyrrolidine-2-carbonyl]imidazolidin-4-one.

Molecular Properties

Compound Name1-[1-(cyclohexanecarbonyl)pyrrolidine-2-carbonyl]imidazolidin-4-one
PubChem CID46994600
Molecular FormulaC15H23N3O3
Molecular Weight293.37 g/mol
Exact Mass293.17
IUPAC Name1-[1-(cyclohexanecarbonyl)pyrrolidine-2-carbonyl]imidazolidin-4-one
SMILESO=C1CN(C(=O)C2CCCN2C(=O)C2CCCCC2)CN1
InChIInChI=1S/C15H23N3O3/c19-13-9-17(10-16-13)15(21)12-7-4-8-18(12)14(20)11-5-2-1-3-6-11/h11-12H,1-10H2,(H,16,19)
InChIKeyCCGZAXLWGIMTSA-UHFFFAOYSA-N
XLogP0.47
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 50.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

cyclopropyl-[2-(3-hydroxyazetidine-1-carbonyl)pyrrolidin-1-yl]methanone
CID 55177817
1-[1-(cyclopropanecarbonyl)pyrrolidine-2-carbonyl]piperidine-3-carboxylic acid
CID 43355899
(3R)-1-[1-(cyclopropanecarbonyl)pyrrolidine-2-carbonyl]piperidine-3-carboxylic acid
CID 81126746
(2R)-1-(cyclopentanecarbonyl)pyrrolidine-2-carboxylic acid
CID 28820041
1-(cyclohexanecarbonyl)azocane-2-carboxylic acid
CID 114239738
(2S)-1-(cyclohexanecarbonyl)piperidine-2-carboxylic acid
CID 42083438
1-(cycloheptanecarbonyl)azepane-2-carboxylic acid
CID 64560695
1-(cyclohexanecarbonyl)azepane-2-carboxylic acid
CID 64559163
cyclohexyl-[2-(4-phenylpiperazine-1-carbonyl)pyrrolidin-1-yl]methanone
CID 55731339
4-(cyclohexanecarbonyl)piperazine-2,6-dione
CID 13063813
[2-[4-(4-chlorobenzoyl)piperazine-1-carbonyl]pyrrolidin-1-yl]-cyclohexylmethanone
CID 55730027
cyclohexyl-[(2R)-2-[(2R)-2-methylmorpholine-4-carbonyl]pyrrolidin-1-yl]methanone
CID 94154419

Frequently Asked Questions

What is the IUPAC name of 1-[1-(cyclohexanecarbonyl)pyrrolidine-2-carbonyl]imidazolidin-4-one?
The IUPAC name of 1-[1-(cyclohexanecarbonyl)pyrrolidine-2-carbonyl]imidazolidin-4-one (CID 46994600) is 1-[1-(cyclohexanecarbonyl)pyrrolidine-2-carbonyl]imidazolidin-4-one.
What is the SMILES notation for 1-[1-(cyclohexanecarbonyl)pyrrolidine-2-carbonyl]imidazolidin-4-one?
The canonical SMILES for 1-[1-(cyclohexanecarbonyl)pyrrolidine-2-carbonyl]imidazolidin-4-one is O=C1CN(C(=O)C2CCCN2C(=O)C2CCCCC2)CN1.
What is the InChIKey of 1-[1-(cyclohexanecarbonyl)pyrrolidine-2-carbonyl]imidazolidin-4-one?
The InChIKey is CCGZAXLWGIMTSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O3/c19-13-9-17(10-16-13)15(21)12-7-4-8-18(12)14(20)11-5-2-1-3-6-11/h11-12H,1-10H2,(H,16,19).
What are the key properties of 1-[1-(cyclohexanecarbonyl)pyrrolidine-2-carbonyl]imidazolidin-4-one?
1-[1-(cyclohexanecarbonyl)pyrrolidine-2-carbonyl]imidazolidin-4-one has a molecular weight of 293.37 g/mol, XLogP of 0.47, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(cyclohexanecarbonyl)pyrrolidine-2-carbonyl]imidazolidin-4-one is sourced from PubChem (CID 46994600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).