1-(2-hydroxyethyl)-3-methyl-4-(1H-pyrrol-3-yl)imidazolidin-2-one

C10H15N3O2 — CID 116981951

IUPAC1-(2-hydroxyethyl)-3-methyl-4-(1H-pyrrol-3-yl)imidazolidin-2-one
SMILESCN1C(=O)N(CCO)CC1c1cc[nH]c1
InChIInChI=1S/C10H15N3O2/c1-12-9(8-2-3-11-6-8)7-13(4-5-14)10(12)15/h2-3,6,9,11,14H,4-5,7H2,1H3
InChIKeyIPWQCTXWMYNBKR-UHFFFAOYSA-N
MW209.25 g/mol
LogP0.42
Rot. Bonds3

About 1-(2-hydroxyethyl)-3-methyl-4-(1H-pyrrol-3-yl)imidazolidin-2-one

1-(2-hydroxyethyl)-3-methyl-4-(1H-pyrrol-3-yl)imidazolidin-2-one (PubChem CID 116981951) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is 1-(2-hydroxyethyl)-3-methyl-4-(1H-pyrrol-3-yl)imidazolidin-2-one.

Molecular Properties

Compound Name1-(2-hydroxyethyl)-3-methyl-4-(1H-pyrrol-3-yl)imidazolidin-2-one
PubChem CID116981951
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC Name1-(2-hydroxyethyl)-3-methyl-4-(1H-pyrrol-3-yl)imidazolidin-2-one
SMILESCN1C(=O)N(CCO)CC1c1cc[nH]c1
InChIInChI=1S/C10H15N3O2/c1-12-9(8-2-3-11-6-8)7-13(4-5-14)10(12)15/h2-3,6,9,11,14H,4-5,7H2,1H3
InChIKeyIPWQCTXWMYNBKR-UHFFFAOYSA-N
XLogP0.42
TPSA59.57 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 50.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2-hydroxyethyl)-3-methyl-4-(1H-pyrrol-3-yl)imidazolidin-2-one?
The IUPAC name of 1-(2-hydroxyethyl)-3-methyl-4-(1H-pyrrol-3-yl)imidazolidin-2-one (CID 116981951) is 1-(2-hydroxyethyl)-3-methyl-4-(1H-pyrrol-3-yl)imidazolidin-2-one.
What is the SMILES notation for 1-(2-hydroxyethyl)-3-methyl-4-(1H-pyrrol-3-yl)imidazolidin-2-one?
The canonical SMILES for 1-(2-hydroxyethyl)-3-methyl-4-(1H-pyrrol-3-yl)imidazolidin-2-one is CN1C(=O)N(CCO)CC1c1cc[nH]c1.
What is the InChIKey of 1-(2-hydroxyethyl)-3-methyl-4-(1H-pyrrol-3-yl)imidazolidin-2-one?
The InChIKey is IPWQCTXWMYNBKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c1-12-9(8-2-3-11-6-8)7-13(4-5-14)10(12)15/h2-3,6,9,11,14H,4-5,7H2,1H3.
What are the key properties of 1-(2-hydroxyethyl)-3-methyl-4-(1H-pyrrol-3-yl)imidazolidin-2-one?
1-(2-hydroxyethyl)-3-methyl-4-(1H-pyrrol-3-yl)imidazolidin-2-one has a molecular weight of 209.25 g/mol, XLogP of 0.42, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-hydroxyethyl)-3-methyl-4-(1H-pyrrol-3-yl)imidazolidin-2-one is sourced from PubChem (CID 116981951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).