4-amino-2-methyl-5-nitroquinolin-8-ol

C10H9N3O3 — CID 69366706

IUPAC4-amino-2-methyl-5-nitroquinolin-8-ol
SMILESCc1cc(N)c2c([N+](=O)[O-])ccc(O)c2n1
InChIInChI=1S/C10H9N3O3/c1-5-4-6(11)9-7(13(15)16)2-3-8(14)10(9)12-5/h2-4,14H,1H3,(H2,11,12)
InChIKeyIURCPTZALOSIHH-UHFFFAOYSA-N
MW219.20 g/mol
LogP1.74
Rot. Bonds1

About 4-amino-2-methyl-5-nitroquinolin-8-ol

4-amino-2-methyl-5-nitroquinolin-8-ol (PubChem CID 69366706) has the molecular formula C10H9N3O3 and a molecular weight of 219.20 g/mol. Its IUPAC name is 4-amino-2-methyl-5-nitroquinolin-8-ol.

Molecular Properties

Compound Name4-amino-2-methyl-5-nitroquinolin-8-ol
PubChem CID69366706
Molecular FormulaC10H9N3O3
Molecular Weight219.20 g/mol
Exact Mass219.06
IUPAC Name4-amino-2-methyl-5-nitroquinolin-8-ol
SMILESCc1cc(N)c2c([N+](=O)[O-])ccc(O)c2n1
InChIInChI=1S/C10H9N3O3/c1-5-4-6(11)9-7(13(15)16)2-3-8(14)10(9)12-5/h2-4,14H,1H3,(H2,11,12)
InChIKeyIURCPTZALOSIHH-UHFFFAOYSA-N
XLogP1.74
TPSA102.28 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.20
LogP ≤ 51.74
H-Bond Donors ≤ 52
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

2-amino-4-methyl-5-nitroquinolin-8-ol
CID 57011206
2-methyl-5-nitroquinolin-8-amine
CID 114289442
2-amino-3-methyl-4-nitrophenol
CID 86240740
2,4,8-trimethyl-7-nitroquinoline
CID 71342477
3-amino-4-nitrophenol;ethane
CID 142035460
2-amino-5-methyl-4-nitrophenol
CID 12781867
5-[(Z)-2-(6-methyl-2-pyridinyl)ethenyl]-2-nitrophenol
CID 69157141
aniline;5-nitroquinolin-8-ol
CID 90427564
2-methyl-4-nitrobenzene-1,3-diol;hydrochloride
CID 174916227
2,4-dimethyl-8-nitroquinoline
CID 608736
6-methyl-2-[(3-methyl-4-nitroanilino)methyl]pyridin-3-ol
CID 79150682
O-(6-methyl-3-nitro-2-pyridinyl)hydroxylamine
CID 81137851

Frequently Asked Questions

What is the IUPAC name of 4-amino-2-methyl-5-nitroquinolin-8-ol?
The IUPAC name of 4-amino-2-methyl-5-nitroquinolin-8-ol (CID 69366706) is 4-amino-2-methyl-5-nitroquinolin-8-ol.
What is the SMILES notation for 4-amino-2-methyl-5-nitroquinolin-8-ol?
The canonical SMILES for 4-amino-2-methyl-5-nitroquinolin-8-ol is Cc1cc(N)c2c([N+](=O)[O-])ccc(O)c2n1.
What is the InChIKey of 4-amino-2-methyl-5-nitroquinolin-8-ol?
The InChIKey is IURCPTZALOSIHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N3O3/c1-5-4-6(11)9-7(13(15)16)2-3-8(14)10(9)12-5/h2-4,14H,1H3,(H2,11,12).
What are the key properties of 4-amino-2-methyl-5-nitroquinolin-8-ol?
4-amino-2-methyl-5-nitroquinolin-8-ol has a molecular weight of 219.20 g/mol, XLogP of 1.74, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-2-methyl-5-nitroquinolin-8-ol is sourced from PubChem (CID 69366706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).