8-[(2,3-dichlorophenyl)methoxy]-N-(1,3-dihydroxypropan-2-yl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide

C19H19Cl2N3O4 — CID 90115122

IUPAC8-[(2,3-dichlorophenyl)methoxy]-N-(1,3-dihydroxypropan-2-yl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1nc2c(OCc3cccc(Cl)c3Cl)cccn2c1C(=O)NC(CO)CO
InChIInChI=1S/C19H19Cl2N3O4/c1-11-17(19(27)23-13(8-25)9-26)24-7-3-6-15(18(24)22-11)28-10-12-4-2-5-14(20)16(12)21/h2-7,13,25-26H,8-10H2,1H3,(H,23,27)
InChIKeyDTMZQWDZAZYGSC-UHFFFAOYSA-N
MW424.28 g/mol
LogP2.61
Rot. Bonds7

About 8-[(2,3-dichlorophenyl)methoxy]-N-(1,3-dihydroxypropan-2-yl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide

8-[(2,3-dichlorophenyl)methoxy]-N-(1,3-dihydroxypropan-2-yl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 90115122) has the molecular formula C19H19Cl2N3O4 and a molecular weight of 424.28 g/mol. Its IUPAC name is 8-[(2,3-dichlorophenyl)methoxy]-N-(1,3-dihydroxypropan-2-yl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name8-[(2,3-dichlorophenyl)methoxy]-N-(1,3-dihydroxypropan-2-yl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide
PubChem CID90115122
Molecular FormulaC19H19Cl2N3O4
Molecular Weight424.28 g/mol
Exact Mass423.08
IUPAC Name8-[(2,3-dichlorophenyl)methoxy]-N-(1,3-dihydroxypropan-2-yl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1nc2c(OCc3cccc(Cl)c3Cl)cccn2c1C(=O)NC(CO)CO
InChIInChI=1S/C19H19Cl2N3O4/c1-11-17(19(27)23-13(8-25)9-26)24-7-3-6-15(18(24)22-11)28-10-12-4-2-5-14(20)16(12)21/h2-7,13,25-26H,8-10H2,1H3,(H,23,27)
InChIKeyDTMZQWDZAZYGSC-UHFFFAOYSA-N
XLogP2.61
TPSA96.09 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.28
LogP ≤ 52.61
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 8-[(2,3-dichlorophenyl)methoxy]-N-(1,3-dihydroxypropan-2-yl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of 8-[(2,3-dichlorophenyl)methoxy]-N-(1,3-dihydroxypropan-2-yl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide (CID 90115122) is 8-[(2,3-dichlorophenyl)methoxy]-N-(1,3-dihydroxypropan-2-yl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for 8-[(2,3-dichlorophenyl)methoxy]-N-(1,3-dihydroxypropan-2-yl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for 8-[(2,3-dichlorophenyl)methoxy]-N-(1,3-dihydroxypropan-2-yl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide is Cc1nc2c(OCc3cccc(Cl)c3Cl)cccn2c1C(=O)NC(CO)CO.
What is the InChIKey of 8-[(2,3-dichlorophenyl)methoxy]-N-(1,3-dihydroxypropan-2-yl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is DTMZQWDZAZYGSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19Cl2N3O4/c1-11-17(19(27)23-13(8-25)9-26)24-7-3-6-15(18(24)22-11)28-10-12-4-2-5-14(20)16(12)21/h2-7,13,25-26H,8-10H2,1H3,(H,23,27).
What are the key properties of 8-[(2,3-dichlorophenyl)methoxy]-N-(1,3-dihydroxypropan-2-yl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide?
8-[(2,3-dichlorophenyl)methoxy]-N-(1,3-dihydroxypropan-2-yl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 424.28 g/mol, XLogP of 2.61, 7 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[(2,3-dichlorophenyl)methoxy]-N-(1,3-dihydroxypropan-2-yl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 90115122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).