N-cyclopentyl-4-(5-methyl-8-oxoimidazo[1,2-d][1,2,4]triazin-7-yl)butanamide

C15H21N5O2 — CID 6625389

IUPACN-cyclopentyl-4-(5-methyl-8-oxoimidazo[1,2-d][1,2,4]triazin-7-yl)butanamide
SMILESCc1nn(CCCC(=O)NC2CCCC2)c(=O)c2nccn12
InChIInChI=1S/C15H21N5O2/c1-11-18-20(15(22)14-16-8-10-19(11)14)9-4-7-13(21)17-12-5-2-3-6-12/h8,10,12H,2-7,9H2,1H3,(H,17,21)
InChIKeyJGIIFGUALAEVNF-UHFFFAOYSA-N
MW303.37 g/mol
LogP1.04
Rot. Bonds5

About N-cyclopentyl-4-(5-methyl-8-oxoimidazo[1,2-d][1,2,4]triazin-7-yl)butanamide

N-cyclopentyl-4-(5-methyl-8-oxoimidazo[1,2-d][1,2,4]triazin-7-yl)butanamide (PubChem CID 6625389) has the molecular formula C15H21N5O2 and a molecular weight of 303.37 g/mol. Its IUPAC name is N-cyclopentyl-4-(5-methyl-8-oxoimidazo[1,2-d][1,2,4]triazin-7-yl)butanamide.

Molecular Properties

Compound NameN-cyclopentyl-4-(5-methyl-8-oxoimidazo[1,2-d][1,2,4]triazin-7-yl)butanamide
PubChem CID6625389
Molecular FormulaC15H21N5O2
Molecular Weight303.37 g/mol
Exact Mass303.17
IUPAC NameN-cyclopentyl-4-(5-methyl-8-oxoimidazo[1,2-d][1,2,4]triazin-7-yl)butanamide
SMILESCc1nn(CCCC(=O)NC2CCCC2)c(=O)c2nccn12
InChIInChI=1S/C15H21N5O2/c1-11-18-20(15(22)14-16-8-10-19(11)14)9-4-7-13(21)17-12-5-2-3-6-12/h8,10,12H,2-7,9H2,1H3,(H,17,21)
InChIKeyJGIIFGUALAEVNF-UHFFFAOYSA-N
XLogP1.04
TPSA81.29 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.37
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-4-(5-methyl-8-oxoimidazo[1,2-d][1,2,4]triazin-7-yl)butanamide?
The IUPAC name of N-cyclopentyl-4-(5-methyl-8-oxoimidazo[1,2-d][1,2,4]triazin-7-yl)butanamide (CID 6625389) is N-cyclopentyl-4-(5-methyl-8-oxoimidazo[1,2-d][1,2,4]triazin-7-yl)butanamide.
What is the SMILES notation for N-cyclopentyl-4-(5-methyl-8-oxoimidazo[1,2-d][1,2,4]triazin-7-yl)butanamide?
The canonical SMILES for N-cyclopentyl-4-(5-methyl-8-oxoimidazo[1,2-d][1,2,4]triazin-7-yl)butanamide is Cc1nn(CCCC(=O)NC2CCCC2)c(=O)c2nccn12.
What is the InChIKey of N-cyclopentyl-4-(5-methyl-8-oxoimidazo[1,2-d][1,2,4]triazin-7-yl)butanamide?
The InChIKey is JGIIFGUALAEVNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5O2/c1-11-18-20(15(22)14-16-8-10-19(11)14)9-4-7-13(21)17-12-5-2-3-6-12/h8,10,12H,2-7,9H2,1H3,(H,17,21).
What are the key properties of N-cyclopentyl-4-(5-methyl-8-oxoimidazo[1,2-d][1,2,4]triazin-7-yl)butanamide?
N-cyclopentyl-4-(5-methyl-8-oxoimidazo[1,2-d][1,2,4]triazin-7-yl)butanamide has a molecular weight of 303.37 g/mol, XLogP of 1.04, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-4-(5-methyl-8-oxoimidazo[1,2-d][1,2,4]triazin-7-yl)butanamide is sourced from PubChem (CID 6625389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).