2-(cyclopropylmethoxy)-6-(3-methoxypropoxy)pyridin-3-amine

C13H20N2O3 — CID 54936573

IUPAC2-(cyclopropylmethoxy)-6-(3-methoxypropoxy)pyridin-3-amine
SMILESCOCCCOc1ccc(N)c(OCC2CC2)n1
InChIInChI=1S/C13H20N2O3/c1-16-7-2-8-17-12-6-5-11(14)13(15-12)18-9-10-3-4-10/h5-6,10H,2-4,7-9,14H2,1H3
InChIKeyAUPPUPUODBLJQQ-UHFFFAOYSA-N
MW252.31 g/mol
LogP1.87
Rot. Bonds8

About 2-(cyclopropylmethoxy)-6-(3-methoxypropoxy)pyridin-3-amine

2-(cyclopropylmethoxy)-6-(3-methoxypropoxy)pyridin-3-amine (PubChem CID 54936573) has the molecular formula C13H20N2O3 and a molecular weight of 252.31 g/mol. Its IUPAC name is 2-(cyclopropylmethoxy)-6-(3-methoxypropoxy)pyridin-3-amine.

Molecular Properties

Compound Name2-(cyclopropylmethoxy)-6-(3-methoxypropoxy)pyridin-3-amine
PubChem CID54936573
Molecular FormulaC13H20N2O3
Molecular Weight252.31 g/mol
Exact Mass252.15
IUPAC Name2-(cyclopropylmethoxy)-6-(3-methoxypropoxy)pyridin-3-amine
SMILESCOCCCOc1ccc(N)c(OCC2CC2)n1
InChIInChI=1S/C13H20N2O3/c1-16-7-2-8-17-12-6-5-11(14)13(15-12)18-9-10-3-4-10/h5-6,10H,2-4,7-9,14H2,1H3
InChIKeyAUPPUPUODBLJQQ-UHFFFAOYSA-N
XLogP1.87
TPSA66.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.31
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(cyclopropylmethoxy)-6-[2-(2-methoxyethoxy)ethoxy]pyridin-3-amine
CID 104559953
2-(cyclopropylmethoxy)-6-heptoxypyridin-3-amine
CID 43262507
2-(cyclopropylmethoxy)-6-(4-methylpentoxy)pyridin-3-amine
CID 43262521
2-(cyclopropylmethoxy)-6-(2-propan-2-yloxyethoxy)pyridin-3-amine
CID 43262301
2-(cyclopropylmethoxy)-6-(2,2,2-trifluoroethoxy)pyridin-3-amine
CID 43261927
6-(2-cyclopropylethoxy)-2-ethoxypyridin-3-amine
CID 106199648
2-(cyclopropylmethoxy)-6-(4-iodophenoxy)pyridin-3-amine
CID 43262556
2-methoxy-6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pyridin-3-amine
CID 104559880
6-(5-bromo-2-methylphenoxy)-2-(cyclopropylmethoxy)pyridin-3-amine
CID 107283325
6-[(5-chloro-3-pyridinyl)oxy]-2-(cyclopropylmethoxy)pyridin-3-amine
CID 64601345
2-[2-(3-methoxypropoxy)ethoxy]-6-methylpyridin-3-amine
CID 103176853
5-amino-6-(cyclopropylmethoxy)pyridine-2-carboxylic acid
CID 114408700

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethoxy)-6-(3-methoxypropoxy)pyridin-3-amine?
The IUPAC name of 2-(cyclopropylmethoxy)-6-(3-methoxypropoxy)pyridin-3-amine (CID 54936573) is 2-(cyclopropylmethoxy)-6-(3-methoxypropoxy)pyridin-3-amine.
What is the SMILES notation for 2-(cyclopropylmethoxy)-6-(3-methoxypropoxy)pyridin-3-amine?
The canonical SMILES for 2-(cyclopropylmethoxy)-6-(3-methoxypropoxy)pyridin-3-amine is COCCCOc1ccc(N)c(OCC2CC2)n1.
What is the InChIKey of 2-(cyclopropylmethoxy)-6-(3-methoxypropoxy)pyridin-3-amine?
The InChIKey is AUPPUPUODBLJQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O3/c1-16-7-2-8-17-12-6-5-11(14)13(15-12)18-9-10-3-4-10/h5-6,10H,2-4,7-9,14H2,1H3.
What are the key properties of 2-(cyclopropylmethoxy)-6-(3-methoxypropoxy)pyridin-3-amine?
2-(cyclopropylmethoxy)-6-(3-methoxypropoxy)pyridin-3-amine has a molecular weight of 252.31 g/mol, XLogP of 1.87, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethoxy)-6-(3-methoxypropoxy)pyridin-3-amine is sourced from PubChem (CID 54936573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).