[2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]-(pyridin-2-ylamino)methanol

C19H14Cl2N4O — CID 68625206

IUPAC[2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]-(pyridin-2-ylamino)methanol
SMILESOC(Nc1ccccn1)c1c(-c2ccc(Cl)cc2Cl)nc2ccccn12
InChIInChI=1S/C19H14Cl2N4O/c20-12-7-8-13(14(21)11-12)17-18(25-10-4-2-6-16(25)24-17)19(26)23-15-5-1-3-9-22-15/h1-11,19,26H,(H,22,23)
InChIKeyZCJLJBNABHNKRT-UHFFFAOYSA-N
MW385.25 g/mol
LogP4.81
Rot. Bonds4

About [2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]-(pyridin-2-ylamino)methanol

[2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]-(pyridin-2-ylamino)methanol (PubChem CID 68625206) has the molecular formula C19H14Cl2N4O and a molecular weight of 385.25 g/mol. Its IUPAC name is [2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]-(pyridin-2-ylamino)methanol.

Molecular Properties

Compound Name[2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]-(pyridin-2-ylamino)methanol
PubChem CID68625206
Molecular FormulaC19H14Cl2N4O
Molecular Weight385.25 g/mol
Exact Mass384.05
IUPAC Name[2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]-(pyridin-2-ylamino)methanol
SMILESOC(Nc1ccccn1)c1c(-c2ccc(Cl)cc2Cl)nc2ccccn12
InChIInChI=1S/C19H14Cl2N4O/c20-12-7-8-13(14(21)11-12)17-18(25-10-4-2-6-16(25)24-17)19(26)23-15-5-1-3-9-22-15/h1-11,19,26H,(H,22,23)
InChIKeyZCJLJBNABHNKRT-UHFFFAOYSA-N
XLogP4.81
TPSA62.45 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.25
LogP ≤ 54.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]-(pyridin-2-ylamino)methanol?
The IUPAC name of [2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]-(pyridin-2-ylamino)methanol (CID 68625206) is [2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]-(pyridin-2-ylamino)methanol.
What is the SMILES notation for [2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]-(pyridin-2-ylamino)methanol?
The canonical SMILES for [2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]-(pyridin-2-ylamino)methanol is OC(Nc1ccccn1)c1c(-c2ccc(Cl)cc2Cl)nc2ccccn12.
What is the InChIKey of [2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]-(pyridin-2-ylamino)methanol?
The InChIKey is ZCJLJBNABHNKRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14Cl2N4O/c20-12-7-8-13(14(21)11-12)17-18(25-10-4-2-6-16(25)24-17)19(26)23-15-5-1-3-9-22-15/h1-11,19,26H,(H,22,23).
What are the key properties of [2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]-(pyridin-2-ylamino)methanol?
[2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]-(pyridin-2-ylamino)methanol has a molecular weight of 385.25 g/mol, XLogP of 4.81, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]-(pyridin-2-ylamino)methanol is sourced from PubChem (CID 68625206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).