2-methyl-6-nitroquinolin-4-amine

C10H9N3O2 — CID 11735841

IUPAC2-methyl-6-nitroquinolin-4-amine
SMILESCc1cc(N)c2cc([N+](=O)[O-])ccc2n1
InChIInChI=1S/C10H9N3O2/c1-6-4-9(11)8-5-7(13(14)15)2-3-10(8)12-6/h2-5H,1H3,(H2,11,12)
InChIKeyBJGZNGVTLAUJID-UHFFFAOYSA-N
MW203.20 g/mol
LogP2.03
Rot. Bonds1

About 2-methyl-6-nitroquinolin-4-amine

2-methyl-6-nitroquinolin-4-amine (PubChem CID 11735841) has the molecular formula C10H9N3O2 and a molecular weight of 203.20 g/mol. Its IUPAC name is 2-methyl-6-nitroquinolin-4-amine.

Molecular Properties

Compound Name2-methyl-6-nitroquinolin-4-amine
PubChem CID11735841
Molecular FormulaC10H9N3O2
Molecular Weight203.20 g/mol
Exact Mass203.07
IUPAC Name2-methyl-6-nitroquinolin-4-amine
SMILESCc1cc(N)c2cc([N+](=O)[O-])ccc2n1
InChIInChI=1S/C10H9N3O2/c1-6-4-9(11)8-5-7(13(14)15)2-3-10(8)12-6/h2-5H,1H3,(H2,11,12)
InChIKeyBJGZNGVTLAUJID-UHFFFAOYSA-N
XLogP2.03
TPSA82.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.20
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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-methyl-6-nitroquinoline-4-carboxylic acid
CID 16637250
4-methoxy-2-methyl-6-nitroquinoline
CID 46708178
2-methyl-6-nitroquinoline-4-carboxamide
CID 22397065
3-nitroacridin-9-amine
CID 26592
2-[(2-methyl-6-nitroquinolin-4-yl)amino]propan-1-ol
CID 75520155
5-methyl-9-nitro-[1,2,4]triazolo[1,5-c]quinazolin-2-amine
CID 121215796
2-methyl-6-nitro-N-propylquinoline-4-carboxamide
CID 110489389
4-amino-2-methylquinoline-6-carboxylic acid;hydrochloride
CID 139269662
2-methyl-6-nitro-4-phenylquinazoline
CID 4662097
2-(chloromethyl)-4-methyl-6-nitroquinoline
CID 139719779
2-methylquinolin-4-amine
CID 162035180
aniline;2-methyl-5-nitroaniline
CID 154966094

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-nitroquinolin-4-amine?
The IUPAC name of 2-methyl-6-nitroquinolin-4-amine (CID 11735841) is 2-methyl-6-nitroquinolin-4-amine.
What is the SMILES notation for 2-methyl-6-nitroquinolin-4-amine?
The canonical SMILES for 2-methyl-6-nitroquinolin-4-amine is Cc1cc(N)c2cc([N+](=O)[O-])ccc2n1.
What is the InChIKey of 2-methyl-6-nitroquinolin-4-amine?
The InChIKey is BJGZNGVTLAUJID-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N3O2/c1-6-4-9(11)8-5-7(13(14)15)2-3-10(8)12-6/h2-5H,1H3,(H2,11,12).
What are the key properties of 2-methyl-6-nitroquinolin-4-amine?
2-methyl-6-nitroquinolin-4-amine has a molecular weight of 203.20 g/mol, XLogP of 2.03, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-nitroquinolin-4-amine is sourced from PubChem (CID 11735841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).