6-methoxy-N-methyl-3-nitro-N-propylpyridin-2-amine

C10H15N3O3 — CID 58903907

IUPAC6-methoxy-N-methyl-3-nitro-N-propylpyridin-2-amine
SMILESCCCN(C)c1nc(OC)ccc1[N+](=O)[O-]
InChIInChI=1S/C10H15N3O3/c1-4-7-12(2)10-8(13(14)15)5-6-9(11-10)16-3/h5-6H,4,7H2,1-3H3
InChIKeyBWMVAVOQWDOVPA-UHFFFAOYSA-N
MW225.25 g/mol
LogP1.84
Rot. Bonds5

About 6-methoxy-N-methyl-3-nitro-N-propylpyridin-2-amine

6-methoxy-N-methyl-3-nitro-N-propylpyridin-2-amine (PubChem CID 58903907) has the molecular formula C10H15N3O3 and a molecular weight of 225.25 g/mol. Its IUPAC name is 6-methoxy-N-methyl-3-nitro-N-propylpyridin-2-amine.

Molecular Properties

Compound Name6-methoxy-N-methyl-3-nitro-N-propylpyridin-2-amine
PubChem CID58903907
Molecular FormulaC10H15N3O3
Molecular Weight225.25 g/mol
Exact Mass225.11
IUPAC Name6-methoxy-N-methyl-3-nitro-N-propylpyridin-2-amine
SMILESCCCN(C)c1nc(OC)ccc1[N+](=O)[O-]
InChIInChI=1S/C10H15N3O3/c1-4-7-12(2)10-8(13(14)15)5-6-9(11-10)16-3/h5-6H,4,7H2,1-3H3
InChIKeyBWMVAVOQWDOVPA-UHFFFAOYSA-N
XLogP1.84
TPSA68.50 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 51.84
H-Bond Donors ≤ 50
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

4-[(6-methoxy-3-nitro-2-pyridinyl)-methylamino]butan-2-ol
CID 113252246
6-methoxy-N,N-dimethyl-3-nitropyridin-2-amine
CID 53407025
3-[(6-methoxy-3-nitro-2-pyridinyl)-methylamino]propane-1,2-diol
CID 69333966
N-(azetidin-3-yl)-6-methoxy-N-methyl-3-nitropyridin-2-amine
CID 113286974
6-methoxy-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-3-nitropyridin-2-amine
CID 154749946
N-butyl-6-chloro-N-methyl-3-nitropyridin-2-amine
CID 43152647
3-[(6-methoxy-3-nitro-2-pyridinyl)-propan-2-ylamino]propan-1-ol
CID 115323357
2-[cyclohexyl-(6-methoxy-3-nitro-2-pyridinyl)amino]ethanol
CID 58903886
N-[2-(aminomethyl)cyclopentyl]-N-ethyl-6-methoxy-3-nitropyridin-2-amine
CID 115323291
2-[methyl-(6-methyl-3-nitro-2-pyridinyl)amino]ethanol
CID 81137666
1-(6-methoxy-3-nitro-2-pyridinyl)-N,N-dimethylethanamine
CID 174432384
6-N-ethyl-2-N-methyl-3-nitro-2-N-pentylpyridine-2,6-diamine
CID 80782981

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-N-methyl-3-nitro-N-propylpyridin-2-amine?
The IUPAC name of 6-methoxy-N-methyl-3-nitro-N-propylpyridin-2-amine (CID 58903907) is 6-methoxy-N-methyl-3-nitro-N-propylpyridin-2-amine.
What is the SMILES notation for 6-methoxy-N-methyl-3-nitro-N-propylpyridin-2-amine?
The canonical SMILES for 6-methoxy-N-methyl-3-nitro-N-propylpyridin-2-amine is CCCN(C)c1nc(OC)ccc1[N+](=O)[O-].
What is the InChIKey of 6-methoxy-N-methyl-3-nitro-N-propylpyridin-2-amine?
The InChIKey is BWMVAVOQWDOVPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O3/c1-4-7-12(2)10-8(13(14)15)5-6-9(11-10)16-3/h5-6H,4,7H2,1-3H3.
What are the key properties of 6-methoxy-N-methyl-3-nitro-N-propylpyridin-2-amine?
6-methoxy-N-methyl-3-nitro-N-propylpyridin-2-amine has a molecular weight of 225.25 g/mol, XLogP of 1.84, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-N-methyl-3-nitro-N-propylpyridin-2-amine is sourced from PubChem (CID 58903907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).