N-[2-methyl-3-(tetrazol-1-yl)phenyl]imidazo[1,2-a]pyridine-2-carboxamide

C16H13N7O — CID 4880293

IUPACN-[2-methyl-3-(tetrazol-1-yl)phenyl]imidazo[1,2-a]pyridine-2-carboxamide
SMILESCc1c(NC(=O)c2cn3ccccc3n2)cccc1-n1cnnn1
InChIInChI=1S/C16H13N7O/c1-11-12(5-4-6-14(11)23-10-17-20-21-23)19-16(24)13-9-22-8-3-2-7-15(22)18-13/h2-10H,1H3,(H,19,24)
InChIKeyOVJGFNDHJCXFDM-UHFFFAOYSA-N
MW319.33 g/mol
LogP1.87
Rot. Bonds3

About N-[2-methyl-3-(tetrazol-1-yl)phenyl]imidazo[1,2-a]pyridine-2-carboxamide

N-[2-methyl-3-(tetrazol-1-yl)phenyl]imidazo[1,2-a]pyridine-2-carboxamide (PubChem CID 4880293) has the molecular formula C16H13N7O and a molecular weight of 319.33 g/mol. Its IUPAC name is N-[2-methyl-3-(tetrazol-1-yl)phenyl]imidazo[1,2-a]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[2-methyl-3-(tetrazol-1-yl)phenyl]imidazo[1,2-a]pyridine-2-carboxamide
PubChem CID4880293
Molecular FormulaC16H13N7O
Molecular Weight319.33 g/mol
Exact Mass319.12
IUPAC NameN-[2-methyl-3-(tetrazol-1-yl)phenyl]imidazo[1,2-a]pyridine-2-carboxamide
SMILESCc1c(NC(=O)c2cn3ccccc3n2)cccc1-n1cnnn1
InChIInChI=1S/C16H13N7O/c1-11-12(5-4-6-14(11)23-10-17-20-21-23)19-16(24)13-9-22-8-3-2-7-15(22)18-13/h2-10H,1H3,(H,19,24)
InChIKeyOVJGFNDHJCXFDM-UHFFFAOYSA-N
XLogP1.87
TPSA90.00 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.33
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-[2-methyl-3-(tetrazol-1-yl)phenyl]imidazo[1,2-a]pyridine-2-carboxamide?
The IUPAC name of N-[2-methyl-3-(tetrazol-1-yl)phenyl]imidazo[1,2-a]pyridine-2-carboxamide (CID 4880293) is N-[2-methyl-3-(tetrazol-1-yl)phenyl]imidazo[1,2-a]pyridine-2-carboxamide.
What is the SMILES notation for N-[2-methyl-3-(tetrazol-1-yl)phenyl]imidazo[1,2-a]pyridine-2-carboxamide?
The canonical SMILES for N-[2-methyl-3-(tetrazol-1-yl)phenyl]imidazo[1,2-a]pyridine-2-carboxamide is Cc1c(NC(=O)c2cn3ccccc3n2)cccc1-n1cnnn1.
What is the InChIKey of N-[2-methyl-3-(tetrazol-1-yl)phenyl]imidazo[1,2-a]pyridine-2-carboxamide?
The InChIKey is OVJGFNDHJCXFDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N7O/c1-11-12(5-4-6-14(11)23-10-17-20-21-23)19-16(24)13-9-22-8-3-2-7-15(22)18-13/h2-10H,1H3,(H,19,24).
What are the key properties of N-[2-methyl-3-(tetrazol-1-yl)phenyl]imidazo[1,2-a]pyridine-2-carboxamide?
N-[2-methyl-3-(tetrazol-1-yl)phenyl]imidazo[1,2-a]pyridine-2-carboxamide has a molecular weight of 319.33 g/mol, XLogP of 1.87, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methyl-3-(tetrazol-1-yl)phenyl]imidazo[1,2-a]pyridine-2-carboxamide is sourced from PubChem (CID 4880293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).