3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-(1H-pyrazol-4-yl)propanamide

C11H15N5O3 — CID 43430671

IUPAC3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-(1H-pyrazol-4-yl)propanamide
SMILESCC1(C)NC(=O)N(CCC(=O)Nc2cn[nH]c2)C1=O
InChIInChI=1S/C11H15N5O3/c1-11(2)9(18)16(10(19)15-11)4-3-8(17)14-7-5-12-13-6-7/h5-6H,3-4H2,1-2H3,(H,12,13)(H,14,17)(H,15,19)
InChIKeyUWXREOXNIMCSKR-UHFFFAOYSA-N
MW265.27 g/mol
LogP0.07
Rot. Bonds4

About 3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-(1H-pyrazol-4-yl)propanamide

3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-(1H-pyrazol-4-yl)propanamide (PubChem CID 43430671) has the molecular formula C11H15N5O3 and a molecular weight of 265.27 g/mol. Its IUPAC name is 3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-(1H-pyrazol-4-yl)propanamide.

Molecular Properties

Compound Name3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-(1H-pyrazol-4-yl)propanamide
PubChem CID43430671
Molecular FormulaC11H15N5O3
Molecular Weight265.27 g/mol
Exact Mass265.12
IUPAC Name3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-(1H-pyrazol-4-yl)propanamide
SMILESCC1(C)NC(=O)N(CCC(=O)Nc2cn[nH]c2)C1=O
InChIInChI=1S/C11H15N5O3/c1-11(2)9(18)16(10(19)15-11)4-3-8(17)14-7-5-12-13-6-7/h5-6H,3-4H2,1-2H3,(H,12,13)(H,14,17)(H,15,19)
InChIKeyUWXREOXNIMCSKR-UHFFFAOYSA-N
XLogP0.07
TPSA107.19 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.27
LogP ≤ 50.07
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-(1H-pyrazol-4-yl)propanamide?
The IUPAC name of 3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-(1H-pyrazol-4-yl)propanamide (CID 43430671) is 3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-(1H-pyrazol-4-yl)propanamide.
What is the SMILES notation for 3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-(1H-pyrazol-4-yl)propanamide?
The canonical SMILES for 3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-(1H-pyrazol-4-yl)propanamide is CC1(C)NC(=O)N(CCC(=O)Nc2cn[nH]c2)C1=O.
What is the InChIKey of 3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-(1H-pyrazol-4-yl)propanamide?
The InChIKey is UWXREOXNIMCSKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5O3/c1-11(2)9(18)16(10(19)15-11)4-3-8(17)14-7-5-12-13-6-7/h5-6H,3-4H2,1-2H3,(H,12,13)(H,14,17)(H,15,19).
What are the key properties of 3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-(1H-pyrazol-4-yl)propanamide?
3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-(1H-pyrazol-4-yl)propanamide has a molecular weight of 265.27 g/mol, XLogP of 0.07, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-(1H-pyrazol-4-yl)propanamide is sourced from PubChem (CID 43430671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).