(4Z)-1-ethyl-5-hydroxy-4-(1H-pyrrolo[2,3-c]pyridin-3-ylmethylidene)imidazolidin-2-one

C13H14N4O2 — CID 156556129

IUPAC(4Z)-1-ethyl-5-hydroxy-4-(1H-pyrrolo[2,3-c]pyridin-3-ylmethylidene)imidazolidin-2-one
SMILESCCN1C(=O)N/C(=C\c2c[nH]c3cnccc23)C1O
InChIInChI=1S/C13H14N4O2/c1-2-17-12(18)10(16-13(17)19)5-8-6-15-11-7-14-4-3-9(8)11/h3-7,12,15,18H,2H2,1H3,(H,16,19)/b10-5-
InChIKeyCNSJPOYMHAWRFL-YHYXMXQVSA-N
MW258.28 g/mol
LogP1.27
Rot. Bonds2

About (4Z)-1-ethyl-5-hydroxy-4-(1H-pyrrolo[2,3-c]pyridin-3-ylmethylidene)imidazolidin-2-one

(4Z)-1-ethyl-5-hydroxy-4-(1H-pyrrolo[2,3-c]pyridin-3-ylmethylidene)imidazolidin-2-one (PubChem CID 156556129) has the molecular formula C13H14N4O2 and a molecular weight of 258.28 g/mol. Its IUPAC name is (4Z)-1-ethyl-5-hydroxy-4-(1H-pyrrolo[2,3-c]pyridin-3-ylmethylidene)imidazolidin-2-one.

Molecular Properties

Compound Name(4Z)-1-ethyl-5-hydroxy-4-(1H-pyrrolo[2,3-c]pyridin-3-ylmethylidene)imidazolidin-2-one
PubChem CID156556129
Molecular FormulaC13H14N4O2
Molecular Weight258.28 g/mol
Exact Mass258.11
IUPAC Name(4Z)-1-ethyl-5-hydroxy-4-(1H-pyrrolo[2,3-c]pyridin-3-ylmethylidene)imidazolidin-2-one
SMILESCCN1C(=O)N/C(=C\c2c[nH]c3cnccc23)C1O
InChIInChI=1S/C13H14N4O2/c1-2-17-12(18)10(16-13(17)19)5-8-6-15-11-7-14-4-3-9(8)11/h3-7,12,15,18H,2H2,1H3,(H,16,19)/b10-5-
InChIKeyCNSJPOYMHAWRFL-YHYXMXQVSA-N
XLogP1.27
TPSA81.25 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.28
LogP ≤ 51.27
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze (4Z)-1-ethyl-5-hydroxy-4-(1H-pyrrolo[2,3-c]pyridin-3-ylmethylidene)imidazolidin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (4Z)-1-ethyl-5-hydroxy-4-(1H-pyrrolo[2,3-c]pyridin-3-ylmethylidene)imidazolidin-2-one?
The IUPAC name of (4Z)-1-ethyl-5-hydroxy-4-(1H-pyrrolo[2,3-c]pyridin-3-ylmethylidene)imidazolidin-2-one (CID 156556129) is (4Z)-1-ethyl-5-hydroxy-4-(1H-pyrrolo[2,3-c]pyridin-3-ylmethylidene)imidazolidin-2-one.
What is the SMILES notation for (4Z)-1-ethyl-5-hydroxy-4-(1H-pyrrolo[2,3-c]pyridin-3-ylmethylidene)imidazolidin-2-one?
The canonical SMILES for (4Z)-1-ethyl-5-hydroxy-4-(1H-pyrrolo[2,3-c]pyridin-3-ylmethylidene)imidazolidin-2-one is CCN1C(=O)N/C(=C\c2c[nH]c3cnccc23)C1O.
What is the InChIKey of (4Z)-1-ethyl-5-hydroxy-4-(1H-pyrrolo[2,3-c]pyridin-3-ylmethylidene)imidazolidin-2-one?
The InChIKey is CNSJPOYMHAWRFL-YHYXMXQVSA-N. The full InChI is InChI=1S/C13H14N4O2/c1-2-17-12(18)10(16-13(17)19)5-8-6-15-11-7-14-4-3-9(8)11/h3-7,12,15,18H,2H2,1H3,(H,16,19)/b10-5-.
What are the key properties of (4Z)-1-ethyl-5-hydroxy-4-(1H-pyrrolo[2,3-c]pyridin-3-ylmethylidene)imidazolidin-2-one?
(4Z)-1-ethyl-5-hydroxy-4-(1H-pyrrolo[2,3-c]pyridin-3-ylmethylidene)imidazolidin-2-one has a molecular weight of 258.28 g/mol, XLogP of 1.27, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4Z)-1-ethyl-5-hydroxy-4-(1H-pyrrolo[2,3-c]pyridin-3-ylmethylidene)imidazolidin-2-one is sourced from PubChem (CID 156556129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).