N'-hydroxy-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboximidamide

C9H14N4O — CID 83878922

IUPACN'-hydroxy-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboximidamide
SMILESCC1CCCn2cnc(/C(N)=N\O)c21
InChIInChI=1S/C9H14N4O/c1-6-3-2-4-13-5-11-7(8(6)13)9(10)12-14/h5-6,14H,2-4H2,1H3,(H2,10,12)
InChIKeyBQSLFCMFSJKVLU-UHFFFAOYSA-N
MW194.24 g/mol
LogP0.87
Rot. Bonds1

About N'-hydroxy-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboximidamide

N'-hydroxy-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboximidamide (PubChem CID 83878922) has the molecular formula C9H14N4O and a molecular weight of 194.24 g/mol. Its IUPAC name is N'-hydroxy-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboximidamide.

Molecular Properties

Compound NameN'-hydroxy-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboximidamide
PubChem CID83878922
Molecular FormulaC9H14N4O
Molecular Weight194.24 g/mol
Exact Mass194.12
IUPAC NameN'-hydroxy-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboximidamide
SMILESCC1CCCn2cnc(/C(N)=N\O)c21
InChIInChI=1S/C9H14N4O/c1-6-3-2-4-13-5-11-7(8(6)13)9(10)12-14/h5-6,14H,2-4H2,1H3,(H2,10,12)
InChIKeyBQSLFCMFSJKVLU-UHFFFAOYSA-N
XLogP0.87
TPSA76.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.24
LogP ≤ 50.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

4-(8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)butanoic acid
CID 83890689
5-amino-N'-hydroxy-1-methylimidazole-4-carboximidamide
CID 6155041
N'-hydroxy-2-(3-methylpiperidin-1-yl)pyridine-3-carboximidamide
CID 24698019
N'-hydroxy-2-methyl-4-(2-methylpyrrolidin-1-yl)benzenecarboximidamide
CID 81277575
(7S)-14,15-difluoro-N'-hydroxy-12-oxo-2,4,11-triazatetracyclo[11.4.0.02,6.07,11]heptadeca-1(17),3,5,13,15-pentaene-5-carboximidamide
CID 22876642
N'-hydroxy-2-methyl-4-(4-propan-2-ylazepan-1-yl)benzenecarboximidamide
CID 81273838
N'-hydroxy-4-(4-methylazepan-1-yl)benzenecarboximidamide
CID 77001998
N'-hydroxy-4-(3-hydroxypiperidin-1-yl)-2-methylbenzenecarboximidamide
CID 81278183
2-N',3-N'-dihydroxypyrazine-2,3-dicarboximidamide
CID 135525948
N'-hydroxy-4-(4-methylazepane-1-carbonyl)benzenecarboximidamide
CID 77002526
N'-hydroxy-6-(2-methylpyrrolidine-1-carbonyl)pyridine-3-carboximidamide
CID 77005324
3-(3,4-dimethoxypyrrolidin-1-yl)-N'-hydroxypyrazine-2-carboximidamide
CID 136868262

Frequently Asked Questions

What is the IUPAC name of N'-hydroxy-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboximidamide?
The IUPAC name of N'-hydroxy-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboximidamide (CID 83878922) is N'-hydroxy-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboximidamide.
What is the SMILES notation for N'-hydroxy-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboximidamide?
The canonical SMILES for N'-hydroxy-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboximidamide is CC1CCCn2cnc(/C(N)=N\O)c21.
What is the InChIKey of N'-hydroxy-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboximidamide?
The InChIKey is BQSLFCMFSJKVLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4O/c1-6-3-2-4-13-5-11-7(8(6)13)9(10)12-14/h5-6,14H,2-4H2,1H3,(H2,10,12).
What are the key properties of N'-hydroxy-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboximidamide?
N'-hydroxy-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboximidamide has a molecular weight of 194.24 g/mol, XLogP of 0.87, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-hydroxy-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboximidamide is sourced from PubChem (CID 83878922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).