N-[6-(4-methoxyphenyl)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-8-yl]formamide

C19H17N5O2 — CID 46948632

IUPACN-[6-(4-methoxyphenyl)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-8-yl]formamide
SMILESCOc1ccc(-c2cc(NC=O)c3ncc(-c4cnn(C)c4)n3c2)cc1
InChIInChI=1S/C19H17N5O2/c1-23-10-15(8-22-23)18-9-20-19-17(21-12-25)7-14(11-24(18)19)13-3-5-16(26-2)6-4-13/h3-12H,1-2H3,(H,21,25)
InChIKeyFYCAZJOTJDJIBU-UHFFFAOYSA-N
MW347.38 g/mol
LogP2.98
Rot. Bonds5

About N-[6-(4-methoxyphenyl)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-8-yl]formamide

N-[6-(4-methoxyphenyl)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-8-yl]formamide (PubChem CID 46948632) has the molecular formula C19H17N5O2 and a molecular weight of 347.38 g/mol. Its IUPAC name is N-[6-(4-methoxyphenyl)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-8-yl]formamide.

Molecular Properties

Compound NameN-[6-(4-methoxyphenyl)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-8-yl]formamide
PubChem CID46948632
Molecular FormulaC19H17N5O2
Molecular Weight347.38 g/mol
Exact Mass347.14
IUPAC NameN-[6-(4-methoxyphenyl)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-8-yl]formamide
SMILESCOc1ccc(-c2cc(NC=O)c3ncc(-c4cnn(C)c4)n3c2)cc1
InChIInChI=1S/C19H17N5O2/c1-23-10-15(8-22-23)18-9-20-19-17(21-12-25)7-14(11-24(18)19)13-3-5-16(26-2)6-4-13/h3-12H,1-2H3,(H,21,25)
InChIKeyFYCAZJOTJDJIBU-UHFFFAOYSA-N
XLogP2.98
TPSA73.45 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.38
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[6-(4-methoxyphenyl)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-8-yl]formamide?
The IUPAC name of N-[6-(4-methoxyphenyl)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-8-yl]formamide (CID 46948632) is N-[6-(4-methoxyphenyl)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-8-yl]formamide.
What is the SMILES notation for N-[6-(4-methoxyphenyl)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-8-yl]formamide?
The canonical SMILES for N-[6-(4-methoxyphenyl)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-8-yl]formamide is COc1ccc(-c2cc(NC=O)c3ncc(-c4cnn(C)c4)n3c2)cc1.
What is the InChIKey of N-[6-(4-methoxyphenyl)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-8-yl]formamide?
The InChIKey is FYCAZJOTJDJIBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N5O2/c1-23-10-15(8-22-23)18-9-20-19-17(21-12-25)7-14(11-24(18)19)13-3-5-16(26-2)6-4-13/h3-12H,1-2H3,(H,21,25).
What are the key properties of N-[6-(4-methoxyphenyl)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-8-yl]formamide?
N-[6-(4-methoxyphenyl)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-8-yl]formamide has a molecular weight of 347.38 g/mol, XLogP of 2.98, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(4-methoxyphenyl)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-8-yl]formamide is sourced from PubChem (CID 46948632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).