N-[(3-methoxyphenyl)methyl]-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide

C20H19N5O2 — CID 164609463

IUPACN-[(3-methoxyphenyl)methyl]-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide
SMILESCOc1cccc(CNC(=O)c2cnc3ccc(-c4cnn(C)c4)cn23)c1
InChIInChI=1S/C20H19N5O2/c1-24-12-16(10-23-24)15-6-7-19-21-11-18(25(19)13-15)20(26)22-9-14-4-3-5-17(8-14)27-2/h3-8,10-13H,9H2,1-2H3,(H,22,26)
InChIKeyNQBSNOAQGWESIE-UHFFFAOYSA-N
MW361.41 g/mol
LogP2.67
Rot. Bonds5

About N-[(3-methoxyphenyl)methyl]-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide

N-[(3-methoxyphenyl)methyl]-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 164609463) has the molecular formula C20H19N5O2 and a molecular weight of 361.41 g/mol. Its IUPAC name is N-[(3-methoxyphenyl)methyl]-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(3-methoxyphenyl)methyl]-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide
PubChem CID164609463
Molecular FormulaC20H19N5O2
Molecular Weight361.41 g/mol
Exact Mass361.15
IUPAC NameN-[(3-methoxyphenyl)methyl]-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide
SMILESCOc1cccc(CNC(=O)c2cnc3ccc(-c4cnn(C)c4)cn23)c1
InChIInChI=1S/C20H19N5O2/c1-24-12-16(10-23-24)15-6-7-19-21-11-18(25(19)13-15)20(26)22-9-14-4-3-5-17(8-14)27-2/h3-8,10-13H,9H2,1-2H3,(H,22,26)
InChIKeyNQBSNOAQGWESIE-UHFFFAOYSA-N
XLogP2.67
TPSA73.45 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.41
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[(3-methoxyphenyl)methyl]-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of N-[(3-methoxyphenyl)methyl]-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide (CID 164609463) is N-[(3-methoxyphenyl)methyl]-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for N-[(3-methoxyphenyl)methyl]-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for N-[(3-methoxyphenyl)methyl]-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide is COc1cccc(CNC(=O)c2cnc3ccc(-c4cnn(C)c4)cn23)c1.
What is the InChIKey of N-[(3-methoxyphenyl)methyl]-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is NQBSNOAQGWESIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N5O2/c1-24-12-16(10-23-24)15-6-7-19-21-11-18(25(19)13-15)20(26)22-9-14-4-3-5-17(8-14)27-2/h3-8,10-13H,9H2,1-2H3,(H,22,26).
What are the key properties of N-[(3-methoxyphenyl)methyl]-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide?
N-[(3-methoxyphenyl)methyl]-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 361.41 g/mol, XLogP of 2.67, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-methoxyphenyl)methyl]-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 164609463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).