3-(2,5-dioxoimidazolidin-4-yl)-N-(2-hydroxyethyl)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propanamide

C15H23N5O4 — CID 70714353

IUPAC3-(2,5-dioxoimidazolidin-4-yl)-N-(2-hydroxyethyl)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propanamide
SMILESCc1nn(C)c(C)c1CN(CCO)C(=O)CCC1NC(=O)NC1=O
InChIInChI=1S/C15H23N5O4/c1-9-11(10(2)19(3)18-9)8-20(6-7-21)13(22)5-4-12-14(23)17-15(24)16-12/h12,21H,4-8H2,1-3H3,(H2,16,17,23,24)
InChIKeyWDEUQKBFMHYBGJ-UHFFFAOYSA-N
MW337.38 g/mol
LogP-0.65
Rot. Bonds7

About 3-(2,5-dioxoimidazolidin-4-yl)-N-(2-hydroxyethyl)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propanamide

3-(2,5-dioxoimidazolidin-4-yl)-N-(2-hydroxyethyl)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propanamide (PubChem CID 70714353) has the molecular formula C15H23N5O4 and a molecular weight of 337.38 g/mol. Its IUPAC name is 3-(2,5-dioxoimidazolidin-4-yl)-N-(2-hydroxyethyl)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propanamide.

Molecular Properties

Compound Name3-(2,5-dioxoimidazolidin-4-yl)-N-(2-hydroxyethyl)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propanamide
PubChem CID70714353
Molecular FormulaC15H23N5O4
Molecular Weight337.38 g/mol
Exact Mass337.18
IUPAC Name3-(2,5-dioxoimidazolidin-4-yl)-N-(2-hydroxyethyl)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propanamide
SMILESCc1nn(C)c(C)c1CN(CCO)C(=O)CCC1NC(=O)NC1=O
InChIInChI=1S/C15H23N5O4/c1-9-11(10(2)19(3)18-9)8-20(6-7-21)13(22)5-4-12-14(23)17-15(24)16-12/h12,21H,4-8H2,1-3H3,(H2,16,17,23,24)
InChIKeyWDEUQKBFMHYBGJ-UHFFFAOYSA-N
XLogP-0.65
TPSA116.56 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 5-0.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-3-[(4S)-2,5-dioxoimidazolidin-4-yl]-N-methylpropanamide
CID 40797002
N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-3-[(4R)-2,5-dioxoimidazolidin-4-yl]-N-methylpropanamide
CID 40797001
3-(2,5-dioxoimidazolidin-4-yl)-N-ethyl-N-[(4-methoxyphenyl)methyl]propanamide
CID 75511632
N-(2-hydroxyethyl)-1-(4-methoxyphenyl)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]cyclopropane-1-carboxamide
CID 91834430
N-(2-methoxyethyl)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]oxolane-3-carboxamide
CID 77087479
3-(2,5-dioxoimidazolidin-4-yl)-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]propanamide
CID 167754621
N-(2-hydroxyethyl)-N-propan-2-yl-2-(1,3,5-trimethylpyrazol-4-yl)acetamide
CID 43573797
ethyl N-amino-N-[3-(2,5-dioxoimidazolidin-4-yl)propyl]carbamate
CID 19708160
(2S)-N-(2-hydroxyethyl)-2-phenyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]spiro[2.4]heptane-2-carboxamide
CID 126439131
1-(2-hydroxyethyl)-3-[5-methyl-2-(2-methylpropyl)pyrazol-3-yl]-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]urea
CID 72907404
N'-methyl-N'-[(1,3,5-trimethylpyrazol-4-yl)methyl]ethane-1,2-diamine
CID 62682565
N-[[4-(dimethylamino)phenyl]methyl]-N-ethyl-3-(1,3,5-trimethylpyrazol-4-yl)propanamide
CID 134009796

Frequently Asked Questions

What is the IUPAC name of 3-(2,5-dioxoimidazolidin-4-yl)-N-(2-hydroxyethyl)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propanamide?
The IUPAC name of 3-(2,5-dioxoimidazolidin-4-yl)-N-(2-hydroxyethyl)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propanamide (CID 70714353) is 3-(2,5-dioxoimidazolidin-4-yl)-N-(2-hydroxyethyl)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propanamide.
What is the SMILES notation for 3-(2,5-dioxoimidazolidin-4-yl)-N-(2-hydroxyethyl)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propanamide?
The canonical SMILES for 3-(2,5-dioxoimidazolidin-4-yl)-N-(2-hydroxyethyl)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propanamide is Cc1nn(C)c(C)c1CN(CCO)C(=O)CCC1NC(=O)NC1=O.
What is the InChIKey of 3-(2,5-dioxoimidazolidin-4-yl)-N-(2-hydroxyethyl)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propanamide?
The InChIKey is WDEUQKBFMHYBGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5O4/c1-9-11(10(2)19(3)18-9)8-20(6-7-21)13(22)5-4-12-14(23)17-15(24)16-12/h12,21H,4-8H2,1-3H3,(H2,16,17,23,24).
What are the key properties of 3-(2,5-dioxoimidazolidin-4-yl)-N-(2-hydroxyethyl)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propanamide?
3-(2,5-dioxoimidazolidin-4-yl)-N-(2-hydroxyethyl)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propanamide has a molecular weight of 337.38 g/mol, XLogP of -0.65, 7 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,5-dioxoimidazolidin-4-yl)-N-(2-hydroxyethyl)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propanamide is sourced from PubChem (CID 70714353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).