1-[(2-methylimidazo[1,2-a]pyridine-3-carbonyl)amino]-3-phenylurea

C16H15N5O2 — CID 2813615

IUPAC1-[(2-methylimidazo[1,2-a]pyridine-3-carbonyl)amino]-3-phenylurea
SMILESCc1nc2ccccn2c1C(=O)NNC(=O)Nc1ccccc1
InChIInChI=1S/C16H15N5O2/c1-11-14(21-10-6-5-9-13(21)17-11)15(22)19-20-16(23)18-12-7-3-2-4-8-12/h2-10H,1H3,(H,19,22)(H2,18,20,23)
InChIKeyUTQDKLZEUUXTEG-UHFFFAOYSA-N
MW309.33 g/mol
LogP2.11
Rot. Bonds2

About 1-[(2-methylimidazo[1,2-a]pyridine-3-carbonyl)amino]-3-phenylurea

1-[(2-methylimidazo[1,2-a]pyridine-3-carbonyl)amino]-3-phenylurea (PubChem CID 2813615) has the molecular formula C16H15N5O2 and a molecular weight of 309.33 g/mol. Its IUPAC name is 1-[(2-methylimidazo[1,2-a]pyridine-3-carbonyl)amino]-3-phenylurea.

Molecular Properties

Compound Name1-[(2-methylimidazo[1,2-a]pyridine-3-carbonyl)amino]-3-phenylurea
PubChem CID2813615
Molecular FormulaC16H15N5O2
Molecular Weight309.33 g/mol
Exact Mass309.12
IUPAC Name1-[(2-methylimidazo[1,2-a]pyridine-3-carbonyl)amino]-3-phenylurea
SMILESCc1nc2ccccn2c1C(=O)NNC(=O)Nc1ccccc1
InChIInChI=1S/C16H15N5O2/c1-11-14(21-10-6-5-9-13(21)17-11)15(22)19-20-16(23)18-12-7-3-2-4-8-12/h2-10H,1H3,(H,19,22)(H2,18,20,23)
InChIKeyUTQDKLZEUUXTEG-UHFFFAOYSA-N
XLogP2.11
TPSA87.53 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.33
LogP ≤ 52.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 1-[(2-methylimidazo[1,2-a]pyridine-3-carbonyl)amino]-3-phenylurea 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 1-[(2-methylimidazo[1,2-a]pyridine-3-carbonyl)amino]-3-phenylurea?
The IUPAC name of 1-[(2-methylimidazo[1,2-a]pyridine-3-carbonyl)amino]-3-phenylurea (CID 2813615) is 1-[(2-methylimidazo[1,2-a]pyridine-3-carbonyl)amino]-3-phenylurea.
What is the SMILES notation for 1-[(2-methylimidazo[1,2-a]pyridine-3-carbonyl)amino]-3-phenylurea?
The canonical SMILES for 1-[(2-methylimidazo[1,2-a]pyridine-3-carbonyl)amino]-3-phenylurea is Cc1nc2ccccn2c1C(=O)NNC(=O)Nc1ccccc1.
What is the InChIKey of 1-[(2-methylimidazo[1,2-a]pyridine-3-carbonyl)amino]-3-phenylurea?
The InChIKey is UTQDKLZEUUXTEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N5O2/c1-11-14(21-10-6-5-9-13(21)17-11)15(22)19-20-16(23)18-12-7-3-2-4-8-12/h2-10H,1H3,(H,19,22)(H2,18,20,23).
What are the key properties of 1-[(2-methylimidazo[1,2-a]pyridine-3-carbonyl)amino]-3-phenylurea?
1-[(2-methylimidazo[1,2-a]pyridine-3-carbonyl)amino]-3-phenylurea has a molecular weight of 309.33 g/mol, XLogP of 2.11, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-methylimidazo[1,2-a]pyridine-3-carbonyl)amino]-3-phenylurea is sourced from PubChem (CID 2813615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).