N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-1-(4-methylphenyl)tetrazol-5-amine

C17H17N7 — CID 133296661

IUPACN-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-1-(4-methylphenyl)tetrazol-5-amine
SMILESCc1ccc(-n2nnnc2NCc2cn3c(C)cccc3n2)cc1
InChIInChI=1S/C17H17N7/c1-12-6-8-15(9-7-12)24-17(20-21-22-24)18-10-14-11-23-13(2)4-3-5-16(23)19-14/h3-9,11H,10H2,1-2H3,(H,18,20,22)
InChIKeyUPXLZAOGZHRTPV-UHFFFAOYSA-N
MW319.37 g/mol
LogP2.54
Rot. Bonds4

About N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-1-(4-methylphenyl)tetrazol-5-amine

N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-1-(4-methylphenyl)tetrazol-5-amine (PubChem CID 133296661) has the molecular formula C17H17N7 and a molecular weight of 319.37 g/mol. Its IUPAC name is N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-1-(4-methylphenyl)tetrazol-5-amine.

Molecular Properties

Compound NameN-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-1-(4-methylphenyl)tetrazol-5-amine
PubChem CID133296661
Molecular FormulaC17H17N7
Molecular Weight319.37 g/mol
Exact Mass319.15
IUPAC NameN-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-1-(4-methylphenyl)tetrazol-5-amine
SMILESCc1ccc(-n2nnnc2NCc2cn3c(C)cccc3n2)cc1
InChIInChI=1S/C17H17N7/c1-12-6-8-15(9-7-12)24-17(20-21-22-24)18-10-14-11-23-13(2)4-3-5-16(23)19-14/h3-9,11H,10H2,1-2H3,(H,18,20,22)
InChIKeyUPXLZAOGZHRTPV-UHFFFAOYSA-N
XLogP2.54
TPSA72.93 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.37
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-1-(4-methylphenyl)tetrazol-5-amine?
The IUPAC name of N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-1-(4-methylphenyl)tetrazol-5-amine (CID 133296661) is N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-1-(4-methylphenyl)tetrazol-5-amine.
What is the SMILES notation for N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-1-(4-methylphenyl)tetrazol-5-amine?
The canonical SMILES for N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-1-(4-methylphenyl)tetrazol-5-amine is Cc1ccc(-n2nnnc2NCc2cn3c(C)cccc3n2)cc1.
What is the InChIKey of N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-1-(4-methylphenyl)tetrazol-5-amine?
The InChIKey is UPXLZAOGZHRTPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N7/c1-12-6-8-15(9-7-12)24-17(20-21-22-24)18-10-14-11-23-13(2)4-3-5-16(23)19-14/h3-9,11H,10H2,1-2H3,(H,18,20,22).
What are the key properties of N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-1-(4-methylphenyl)tetrazol-5-amine?
N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-1-(4-methylphenyl)tetrazol-5-amine has a molecular weight of 319.37 g/mol, XLogP of 2.54, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-1-(4-methylphenyl)tetrazol-5-amine is sourced from PubChem (CID 133296661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).