N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-4-(tetrazol-1-yl)butanamide

C14H17N7O — CID 118779889

IUPACN-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-4-(tetrazol-1-yl)butanamide
SMILESCc1cccn2cc(CNC(=O)CCCn3cnnn3)nc12
InChIInChI=1S/C14H17N7O/c1-11-4-2-6-20-9-12(17-14(11)20)8-15-13(22)5-3-7-21-10-16-18-19-21/h2,4,6,9-10H,3,5,7-8H2,1H3,(H,15,22)
InChIKeyXJCNSNYFGXTFLI-UHFFFAOYSA-N
MW299.34 g/mol
LogP0.73
Rot. Bonds6

About N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-4-(tetrazol-1-yl)butanamide

N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-4-(tetrazol-1-yl)butanamide (PubChem CID 118779889) has the molecular formula C14H17N7O and a molecular weight of 299.34 g/mol. Its IUPAC name is N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-4-(tetrazol-1-yl)butanamide.

Molecular Properties

Compound NameN-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-4-(tetrazol-1-yl)butanamide
PubChem CID118779889
Molecular FormulaC14H17N7O
Molecular Weight299.34 g/mol
Exact Mass299.15
IUPAC NameN-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-4-(tetrazol-1-yl)butanamide
SMILESCc1cccn2cc(CNC(=O)CCCn3cnnn3)nc12
InChIInChI=1S/C14H17N7O/c1-11-4-2-6-20-9-12(17-14(11)20)8-15-13(22)5-3-7-21-10-16-18-19-21/h2,4,6,9-10H,3,5,7-8H2,1H3,(H,15,22)
InChIKeyXJCNSNYFGXTFLI-UHFFFAOYSA-N
XLogP0.73
TPSA90.00 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.34
LogP ≤ 50.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-4-(tetrazol-1-yl)butanamide?
The IUPAC name of N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-4-(tetrazol-1-yl)butanamide (CID 118779889) is N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-4-(tetrazol-1-yl)butanamide.
What is the SMILES notation for N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-4-(tetrazol-1-yl)butanamide?
The canonical SMILES for N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-4-(tetrazol-1-yl)butanamide is Cc1cccn2cc(CNC(=O)CCCn3cnnn3)nc12.
What is the InChIKey of N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-4-(tetrazol-1-yl)butanamide?
The InChIKey is XJCNSNYFGXTFLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N7O/c1-11-4-2-6-20-9-12(17-14(11)20)8-15-13(22)5-3-7-21-10-16-18-19-21/h2,4,6,9-10H,3,5,7-8H2,1H3,(H,15,22).
What are the key properties of N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-4-(tetrazol-1-yl)butanamide?
N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-4-(tetrazol-1-yl)butanamide has a molecular weight of 299.34 g/mol, XLogP of 0.73, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-4-(tetrazol-1-yl)butanamide is sourced from PubChem (CID 118779889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).