N-(3-chloro-4-methoxyphenyl)-2-methylimidazo[1,2-a]pyridine-6-carboxamide

C16H14ClN3O2 — CID 110704259

IUPACN-(3-chloro-4-methoxyphenyl)-2-methylimidazo[1,2-a]pyridine-6-carboxamide
SMILESCOc1ccc(NC(=O)c2ccc3nc(C)cn3c2)cc1Cl
InChIInChI=1S/C16H14ClN3O2/c1-10-8-20-9-11(3-6-15(20)18-10)16(21)19-12-4-5-14(22-2)13(17)7-12/h3-9H,1-2H3,(H,19,21)
InChIKeyUTGYERRMYILPOR-UHFFFAOYSA-N
MW315.76 g/mol
LogP3.56
Rot. Bonds3

About N-(3-chloro-4-methoxyphenyl)-2-methylimidazo[1,2-a]pyridine-6-carboxamide

N-(3-chloro-4-methoxyphenyl)-2-methylimidazo[1,2-a]pyridine-6-carboxamide (PubChem CID 110704259) has the molecular formula C16H14ClN3O2 and a molecular weight of 315.76 g/mol. Its IUPAC name is N-(3-chloro-4-methoxyphenyl)-2-methylimidazo[1,2-a]pyridine-6-carboxamide.

Molecular Properties

Compound NameN-(3-chloro-4-methoxyphenyl)-2-methylimidazo[1,2-a]pyridine-6-carboxamide
PubChem CID110704259
Molecular FormulaC16H14ClN3O2
Molecular Weight315.76 g/mol
Exact Mass315.08
IUPAC NameN-(3-chloro-4-methoxyphenyl)-2-methylimidazo[1,2-a]pyridine-6-carboxamide
SMILESCOc1ccc(NC(=O)c2ccc3nc(C)cn3c2)cc1Cl
InChIInChI=1S/C16H14ClN3O2/c1-10-8-20-9-11(3-6-15(20)18-10)16(21)19-12-4-5-14(22-2)13(17)7-12/h3-9H,1-2H3,(H,19,21)
InChIKeyUTGYERRMYILPOR-UHFFFAOYSA-N
XLogP3.56
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.76
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-4-methoxyphenyl)-2-methylimidazo[1,2-a]pyridine-6-carboxamide?
The IUPAC name of N-(3-chloro-4-methoxyphenyl)-2-methylimidazo[1,2-a]pyridine-6-carboxamide (CID 110704259) is N-(3-chloro-4-methoxyphenyl)-2-methylimidazo[1,2-a]pyridine-6-carboxamide.
What is the SMILES notation for N-(3-chloro-4-methoxyphenyl)-2-methylimidazo[1,2-a]pyridine-6-carboxamide?
The canonical SMILES for N-(3-chloro-4-methoxyphenyl)-2-methylimidazo[1,2-a]pyridine-6-carboxamide is COc1ccc(NC(=O)c2ccc3nc(C)cn3c2)cc1Cl.
What is the InChIKey of N-(3-chloro-4-methoxyphenyl)-2-methylimidazo[1,2-a]pyridine-6-carboxamide?
The InChIKey is UTGYERRMYILPOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14ClN3O2/c1-10-8-20-9-11(3-6-15(20)18-10)16(21)19-12-4-5-14(22-2)13(17)7-12/h3-9H,1-2H3,(H,19,21).
What are the key properties of N-(3-chloro-4-methoxyphenyl)-2-methylimidazo[1,2-a]pyridine-6-carboxamide?
N-(3-chloro-4-methoxyphenyl)-2-methylimidazo[1,2-a]pyridine-6-carboxamide has a molecular weight of 315.76 g/mol, XLogP of 3.56, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-4-methoxyphenyl)-2-methylimidazo[1,2-a]pyridine-6-carboxamide is sourced from PubChem (CID 110704259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).