N-methyl-1-nitroimidazo[1,5-a]pyridin-8-amine

C8H8N4O2 — CID 83877918

IUPACN-methyl-1-nitroimidazo[1,5-a]pyridin-8-amine
SMILESCNc1cccn2cnc([N+](=O)[O-])c12
InChIInChI=1S/C8H8N4O2/c1-9-6-3-2-4-11-5-10-8(7(6)11)12(13)14/h2-5,9H,1H3
InChIKeyBLRWHLSUMRWYFR-UHFFFAOYSA-N
MW192.18 g/mol
LogP1.28
Rot. Bonds2

About N-methyl-1-nitroimidazo[1,5-a]pyridin-8-amine

N-methyl-1-nitroimidazo[1,5-a]pyridin-8-amine (PubChem CID 83877918) has the molecular formula C8H8N4O2 and a molecular weight of 192.18 g/mol. Its IUPAC name is N-methyl-1-nitroimidazo[1,5-a]pyridin-8-amine.

Molecular Properties

Compound NameN-methyl-1-nitroimidazo[1,5-a]pyridin-8-amine
PubChem CID83877918
Molecular FormulaC8H8N4O2
Molecular Weight192.18 g/mol
Exact Mass192.06
IUPAC NameN-methyl-1-nitroimidazo[1,5-a]pyridin-8-amine
SMILESCNc1cccn2cnc([N+](=O)[O-])c12
InChIInChI=1S/C8H8N4O2/c1-9-6-3-2-4-11-5-10-8(7(6)11)12(13)14/h2-5,9H,1H3
InChIKeyBLRWHLSUMRWYFR-UHFFFAOYSA-N
XLogP1.28
TPSA72.47 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.18
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-methyl-2-nitropyridin-3-amine
CID 555983
2-(1-nitroimidazo[1,5-a]pyridin-8-yl)ethanamine
CID 83882697
1-methyl-8-(4-nitrophenyl)imidazo[1,5-a]pyridine
CID 171801448
N-methyl-3-nitropyridin-2-amine
CID 556349
N,1-dimethyl-4-nitroindazol-3-amine
CID 12649187
N,2,2-trimethyl-3-[(2-nitro-3-pyridinyl)amino]propanamide
CID 103823304
N-methyl-2,3-dinitroaniline
CID 12620251
3-methyl-5-nitro-N-phenylimidazol-4-amine
CID 2837298
3-N-ethyl-1-N,3-N-dimethyl-2-nitrobenzene-1,3-diamine
CID 80774350
2-[(2-nitro-3-pyridinyl)amino]butan-1-ol
CID 115585333
N-(3-ethyl-1-methylpyrazol-4-yl)-2-nitropyridin-3-amine
CID 113349603
4-N-(2,3-dimethylphenyl)-6-N-methyl-5-nitropyrimidine-4,6-diamine
CID 23486904

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-nitroimidazo[1,5-a]pyridin-8-amine?
The IUPAC name of N-methyl-1-nitroimidazo[1,5-a]pyridin-8-amine (CID 83877918) is N-methyl-1-nitroimidazo[1,5-a]pyridin-8-amine.
What is the SMILES notation for N-methyl-1-nitroimidazo[1,5-a]pyridin-8-amine?
The canonical SMILES for N-methyl-1-nitroimidazo[1,5-a]pyridin-8-amine is CNc1cccn2cnc([N+](=O)[O-])c12.
What is the InChIKey of N-methyl-1-nitroimidazo[1,5-a]pyridin-8-amine?
The InChIKey is BLRWHLSUMRWYFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N4O2/c1-9-6-3-2-4-11-5-10-8(7(6)11)12(13)14/h2-5,9H,1H3.
What are the key properties of N-methyl-1-nitroimidazo[1,5-a]pyridin-8-amine?
N-methyl-1-nitroimidazo[1,5-a]pyridin-8-amine has a molecular weight of 192.18 g/mol, XLogP of 1.28, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-nitroimidazo[1,5-a]pyridin-8-amine is sourced from PubChem (CID 83877918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).