4-imino-1-(2-methoxyethyl)-5-(1-methylpyrazol-4-yl)imidazolidin-2-one

C10H15N5O2 — CID 138390235

IUPAC4-imino-1-(2-methoxyethyl)-5-(1-methylpyrazol-4-yl)imidazolidin-2-one
SMILES[H]/N=C1\NC(=O)N(CCOC)C1c1cnn(C)c1
InChIInChI=1S/C10H15N5O2/c1-14-6-7(5-12-14)8-9(11)13-10(16)15(8)3-4-17-2/h5-6,8H,3-4H2,1-2H3,(H2,11,13,16)
InChIKeyJHCKAHXWQJSDNL-UHFFFAOYSA-N
MW237.26 g/mol
LogP0.11
Rot. Bonds4

About 4-imino-1-(2-methoxyethyl)-5-(1-methylpyrazol-4-yl)imidazolidin-2-one

4-imino-1-(2-methoxyethyl)-5-(1-methylpyrazol-4-yl)imidazolidin-2-one (PubChem CID 138390235) has the molecular formula C10H15N5O2 and a molecular weight of 237.26 g/mol. Its IUPAC name is 4-imino-1-(2-methoxyethyl)-5-(1-methylpyrazol-4-yl)imidazolidin-2-one.

Molecular Properties

Compound Name4-imino-1-(2-methoxyethyl)-5-(1-methylpyrazol-4-yl)imidazolidin-2-one
PubChem CID138390235
Molecular FormulaC10H15N5O2
Molecular Weight237.26 g/mol
Exact Mass237.12
IUPAC Name4-imino-1-(2-methoxyethyl)-5-(1-methylpyrazol-4-yl)imidazolidin-2-one
SMILES[H]/N=C1\NC(=O)N(CCOC)C1c1cnn(C)c1
InChIInChI=1S/C10H15N5O2/c1-14-6-7(5-12-14)8-9(11)13-10(16)15(8)3-4-17-2/h5-6,8H,3-4H2,1-2H3,(H2,11,13,16)
InChIKeyJHCKAHXWQJSDNL-UHFFFAOYSA-N
XLogP0.11
TPSA83.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.26
LogP ≤ 50.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

4-imino-5-(1-methylpyrazol-4-yl)-1-prop-2-ynylimidazolidin-2-one
CID 138390744
4-imino-1-(2-methoxyethyl)-5-thiophen-3-ylimidazolidin-2-one
CID 138390169
4-imino-1-(2-methoxyethyl)-5-(4-propan-2-yloxyphenyl)imidazolidin-2-one
CID 138390991
5-(2,6-dichlorophenyl)-4-imino-1-(2-methoxyethyl)imidazolidin-2-one
CID 138390703
5-(2-ethylphenyl)-4-imino-1-(2-methoxyethyl)imidazolidin-2-one
CID 138390315
5-(5-bromothiophen-2-yl)-4-imino-1-(2-methoxyethyl)imidazolidin-2-one
CID 138389790
5-butyl-4-imino-1-(2-methoxyethyl)imidazolidin-2-one
CID 138390237
4-imino-5-(4-methylsulfanylphenyl)-1-propylimidazolidin-2-one
CID 138388758
1-(2-methoxyethyl)-8-methyl-4-(1-methylpyrazol-4-yl)-1,8-diazaspiro[4.5]decan-2-one
CID 134074658
3-(2-methoxyethyl)-5-methyl-5-(1-methylpyrazol-4-yl)imidazolidine-2,4-dione
CID 154737485
1-ethyl-5-(4-ethylphenyl)-4-iminoimidazolidin-2-one
CID 138389994
4-cyclopropyl-1-(2-methoxyethyl)pyrazole
CID 170573805

Frequently Asked Questions

What is the IUPAC name of 4-imino-1-(2-methoxyethyl)-5-(1-methylpyrazol-4-yl)imidazolidin-2-one?
The IUPAC name of 4-imino-1-(2-methoxyethyl)-5-(1-methylpyrazol-4-yl)imidazolidin-2-one (CID 138390235) is 4-imino-1-(2-methoxyethyl)-5-(1-methylpyrazol-4-yl)imidazolidin-2-one.
What is the SMILES notation for 4-imino-1-(2-methoxyethyl)-5-(1-methylpyrazol-4-yl)imidazolidin-2-one?
The canonical SMILES for 4-imino-1-(2-methoxyethyl)-5-(1-methylpyrazol-4-yl)imidazolidin-2-one is [H]/N=C1\NC(=O)N(CCOC)C1c1cnn(C)c1.
What is the InChIKey of 4-imino-1-(2-methoxyethyl)-5-(1-methylpyrazol-4-yl)imidazolidin-2-one?
The InChIKey is JHCKAHXWQJSDNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5O2/c1-14-6-7(5-12-14)8-9(11)13-10(16)15(8)3-4-17-2/h5-6,8H,3-4H2,1-2H3,(H2,11,13,16).
What are the key properties of 4-imino-1-(2-methoxyethyl)-5-(1-methylpyrazol-4-yl)imidazolidin-2-one?
4-imino-1-(2-methoxyethyl)-5-(1-methylpyrazol-4-yl)imidazolidin-2-one has a molecular weight of 237.26 g/mol, XLogP of 0.11, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-imino-1-(2-methoxyethyl)-5-(1-methylpyrazol-4-yl)imidazolidin-2-one is sourced from PubChem (CID 138390235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).