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

C17H16ClN3O2 — CID 71761818

IUPAC7-chloro-N-[(3-methoxyphenyl)methyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCOc1cccc(CNC(=O)c2c(C)nc3cc(Cl)ccn23)c1
InChIInChI=1S/C17H16ClN3O2/c1-11-16(21-7-6-13(18)9-15(21)20-11)17(22)19-10-12-4-3-5-14(8-12)23-2/h3-9H,10H2,1-2H3,(H,19,22)
InChIKeyZAJMSDPAKQNDIN-UHFFFAOYSA-N
MW329.79 g/mol
LogP3.23
Rot. Bonds4

About 7-chloro-N-[(3-methoxyphenyl)methyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide

7-chloro-N-[(3-methoxyphenyl)methyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 71761818) has the molecular formula C17H16ClN3O2 and a molecular weight of 329.79 g/mol. Its IUPAC name is 7-chloro-N-[(3-methoxyphenyl)methyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name7-chloro-N-[(3-methoxyphenyl)methyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide
PubChem CID71761818
Molecular FormulaC17H16ClN3O2
Molecular Weight329.79 g/mol
Exact Mass329.09
IUPAC Name7-chloro-N-[(3-methoxyphenyl)methyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCOc1cccc(CNC(=O)c2c(C)nc3cc(Cl)ccn23)c1
InChIInChI=1S/C17H16ClN3O2/c1-11-16(21-7-6-13(18)9-15(21)20-11)17(22)19-10-12-4-3-5-14(8-12)23-2/h3-9H,10H2,1-2H3,(H,19,22)
InChIKeyZAJMSDPAKQNDIN-UHFFFAOYSA-N
XLogP3.23
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.79
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-chloro-N-[(3-methoxyphenyl)methyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of 7-chloro-N-[(3-methoxyphenyl)methyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide (CID 71761818) is 7-chloro-N-[(3-methoxyphenyl)methyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for 7-chloro-N-[(3-methoxyphenyl)methyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for 7-chloro-N-[(3-methoxyphenyl)methyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide is COc1cccc(CNC(=O)c2c(C)nc3cc(Cl)ccn23)c1.
What is the InChIKey of 7-chloro-N-[(3-methoxyphenyl)methyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is ZAJMSDPAKQNDIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16ClN3O2/c1-11-16(21-7-6-13(18)9-15(21)20-11)17(22)19-10-12-4-3-5-14(8-12)23-2/h3-9H,10H2,1-2H3,(H,19,22).
What are the key properties of 7-chloro-N-[(3-methoxyphenyl)methyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide?
7-chloro-N-[(3-methoxyphenyl)methyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 329.79 g/mol, XLogP of 3.23, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-N-[(3-methoxyphenyl)methyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 71761818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).