6-(2-cyclopropylethoxy)-4-nitropyridin-2-amine

C10H13N3O3 — CID 106207493

IUPAC6-(2-cyclopropylethoxy)-4-nitropyridin-2-amine
SMILESNc1cc([N+](=O)[O-])cc(OCCC2CC2)n1
InChIInChI=1S/C10H13N3O3/c11-9-5-8(13(14)15)6-10(12-9)16-4-3-7-1-2-7/h5-7H,1-4H2,(H2,11,12)
InChIKeyYRQVMGDGZBYIQO-UHFFFAOYSA-N
MW223.23 g/mol
LogP1.75
Rot. Bonds5

About 6-(2-cyclopropylethoxy)-4-nitropyridin-2-amine

6-(2-cyclopropylethoxy)-4-nitropyridin-2-amine (PubChem CID 106207493) has the molecular formula C10H13N3O3 and a molecular weight of 223.23 g/mol. Its IUPAC name is 6-(2-cyclopropylethoxy)-4-nitropyridin-2-amine.

Molecular Properties

Compound Name6-(2-cyclopropylethoxy)-4-nitropyridin-2-amine
PubChem CID106207493
Molecular FormulaC10H13N3O3
Molecular Weight223.23 g/mol
Exact Mass223.10
IUPAC Name6-(2-cyclopropylethoxy)-4-nitropyridin-2-amine
SMILESNc1cc([N+](=O)[O-])cc(OCCC2CC2)n1
InChIInChI=1S/C10H13N3O3/c11-9-5-8(13(14)15)6-10(12-9)16-4-3-7-1-2-7/h5-7H,1-4H2,(H2,11,12)
InChIKeyYRQVMGDGZBYIQO-UHFFFAOYSA-N
XLogP1.75
TPSA91.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.23
LogP ≤ 51.75
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

2-chloro-6-(2-cyclobutylethoxy)-4-nitropyridine
CID 106201462
6-(2-cyclobutylethoxy)-N-methyl-4-nitropyridin-2-amine
CID 114158243
6-[3-(dimethylamino)propoxy]-4-nitropyridin-2-amine
CID 114071350
6-(2-cyclobutylethoxy)-4-nitro-N-propylpyridin-2-amine
CID 106207668
6-(2-cyclopropylethoxy)-3-nitropyridin-2-amine
CID 106207381
2-cyclopropyl-6-(2-cyclopropylethoxy)pyrimidin-4-amine
CID 106207497
1-(2-cyclopropylethoxy)-4-nitrobenzene
CID 67453725
6-(2-cyclobutylethoxy)-3-nitropyridin-2-amine
CID 114158193
4-[[(6-amino-4-nitro-2-pyridinyl)amino]methyl]cyclohexan-1-ol
CID 106138650
6-(2-cyclopropylethoxy)-2-(ethoxymethyl)pyrimidin-4-amine
CID 106207534
4-(2-cyclopropylethoxy)-6-methyl-5-nitropyrimidin-2-amine
CID 106207578
6-(2-bromophenoxy)-4-nitropyridin-2-amine
CID 114071337

Frequently Asked Questions

What is the IUPAC name of 6-(2-cyclopropylethoxy)-4-nitropyridin-2-amine?
The IUPAC name of 6-(2-cyclopropylethoxy)-4-nitropyridin-2-amine (CID 106207493) is 6-(2-cyclopropylethoxy)-4-nitropyridin-2-amine.
What is the SMILES notation for 6-(2-cyclopropylethoxy)-4-nitropyridin-2-amine?
The canonical SMILES for 6-(2-cyclopropylethoxy)-4-nitropyridin-2-amine is Nc1cc([N+](=O)[O-])cc(OCCC2CC2)n1.
What is the InChIKey of 6-(2-cyclopropylethoxy)-4-nitropyridin-2-amine?
The InChIKey is YRQVMGDGZBYIQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O3/c11-9-5-8(13(14)15)6-10(12-9)16-4-3-7-1-2-7/h5-7H,1-4H2,(H2,11,12).
What are the key properties of 6-(2-cyclopropylethoxy)-4-nitropyridin-2-amine?
6-(2-cyclopropylethoxy)-4-nitropyridin-2-amine has a molecular weight of 223.23 g/mol, XLogP of 1.75, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-cyclopropylethoxy)-4-nitropyridin-2-amine is sourced from PubChem (CID 106207493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).