6-(2-methylmorpholin-4-yl)-5-nitropyridin-2-amine

C10H14N4O3 — CID 80764724

IUPAC6-(2-methylmorpholin-4-yl)-5-nitropyridin-2-amine
SMILESCC1CN(c2nc(N)ccc2[N+](=O)[O-])CCO1
InChIInChI=1S/C10H14N4O3/c1-7-6-13(4-5-17-7)10-8(14(15)16)2-3-9(11)12-10/h2-3,7H,4-6H2,1H3,(H2,11,12)
InChIKeyGAGXUSTWNRUQST-UHFFFAOYSA-N
MW238.25 g/mol
LogP0.80
Rot. Bonds2

About 6-(2-methylmorpholin-4-yl)-5-nitropyridin-2-amine

6-(2-methylmorpholin-4-yl)-5-nitropyridin-2-amine (PubChem CID 80764724) has the molecular formula C10H14N4O3 and a molecular weight of 238.25 g/mol. Its IUPAC name is 6-(2-methylmorpholin-4-yl)-5-nitropyridin-2-amine.

Molecular Properties

Compound Name6-(2-methylmorpholin-4-yl)-5-nitropyridin-2-amine
PubChem CID80764724
Molecular FormulaC10H14N4O3
Molecular Weight238.25 g/mol
Exact Mass238.11
IUPAC Name6-(2-methylmorpholin-4-yl)-5-nitropyridin-2-amine
SMILESCC1CN(c2nc(N)ccc2[N+](=O)[O-])CCO1
InChIInChI=1S/C10H14N4O3/c1-7-6-13(4-5-17-7)10-8(14(15)16)2-3-9(11)12-10/h2-3,7H,4-6H2,1H3,(H2,11,12)
InChIKeyGAGXUSTWNRUQST-UHFFFAOYSA-N
XLogP0.80
TPSA94.52 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.25
LogP ≤ 50.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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

6-(3-methylpiperidin-1-yl)-5-nitropyridin-2-amine
CID 80763904
6-(3-ethyl-4-methylpiperazin-1-yl)-5-nitropyridin-2-amine
CID 80834838
5-nitro-6-piperazin-1-ylpyridin-2-amine
CID 80837104
(2S,6R)-4-(6-chloro-3-nitro-2-pyridinyl)-2,6-dimethylmorpholine
CID 104959790
5-amino-6-(2-methylmorpholin-4-yl)pyridine-2-carboxamide
CID 114404954
2-methyl-4-(4-nitrophenyl)morpholine
CID 71113420
2-(2-methylmorpholin-4-yl)-5-nitroaniline
CID 55080390
6-(3,3-diethylpyrrolidin-1-yl)-5-nitropyridin-2-amine
CID 80855316
ethyl 4-(6-amino-3-nitro-2-pyridinyl)piperazine-1-carboxylate
CID 12919353
6-chloro-2-(3,4-dimethylpyrrolidin-1-yl)-3-nitropyridine
CID 79180812
1-[4-(6-methoxy-3-nitro-2-pyridinyl)morpholin-2-yl]-N-methylmethanamine
CID 115323324
6-(3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-5-nitropyridin-2-amine
CID 80836642

Frequently Asked Questions

What is the IUPAC name of 6-(2-methylmorpholin-4-yl)-5-nitropyridin-2-amine?
The IUPAC name of 6-(2-methylmorpholin-4-yl)-5-nitropyridin-2-amine (CID 80764724) is 6-(2-methylmorpholin-4-yl)-5-nitropyridin-2-amine.
What is the SMILES notation for 6-(2-methylmorpholin-4-yl)-5-nitropyridin-2-amine?
The canonical SMILES for 6-(2-methylmorpholin-4-yl)-5-nitropyridin-2-amine is CC1CN(c2nc(N)ccc2[N+](=O)[O-])CCO1.
What is the InChIKey of 6-(2-methylmorpholin-4-yl)-5-nitropyridin-2-amine?
The InChIKey is GAGXUSTWNRUQST-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4O3/c1-7-6-13(4-5-17-7)10-8(14(15)16)2-3-9(11)12-10/h2-3,7H,4-6H2,1H3,(H2,11,12).
What are the key properties of 6-(2-methylmorpholin-4-yl)-5-nitropyridin-2-amine?
6-(2-methylmorpholin-4-yl)-5-nitropyridin-2-amine has a molecular weight of 238.25 g/mol, XLogP of 0.80, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-methylmorpholin-4-yl)-5-nitropyridin-2-amine is sourced from PubChem (CID 80764724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).