2-(cyclopropylmethoxy)-6-(4-methylpentoxy)pyridin-3-amine

C15H24N2O2 — CID 43262521

IUPAC2-(cyclopropylmethoxy)-6-(4-methylpentoxy)pyridin-3-amine
SMILESCC(C)CCCOc1ccc(N)c(OCC2CC2)n1
InChIInChI=1S/C15H24N2O2/c1-11(2)4-3-9-18-14-8-7-13(16)15(17-14)19-10-12-5-6-12/h7-8,11-12H,3-6,9-10,16H2,1-2H3
InChIKeyJXKLDNGVIICJDJ-UHFFFAOYSA-N
MW264.37 g/mol
LogP3.27
Rot. Bonds8

About 2-(cyclopropylmethoxy)-6-(4-methylpentoxy)pyridin-3-amine

2-(cyclopropylmethoxy)-6-(4-methylpentoxy)pyridin-3-amine (PubChem CID 43262521) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 2-(cyclopropylmethoxy)-6-(4-methylpentoxy)pyridin-3-amine.

Molecular Properties

Compound Name2-(cyclopropylmethoxy)-6-(4-methylpentoxy)pyridin-3-amine
PubChem CID43262521
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name2-(cyclopropylmethoxy)-6-(4-methylpentoxy)pyridin-3-amine
SMILESCC(C)CCCOc1ccc(N)c(OCC2CC2)n1
InChIInChI=1S/C15H24N2O2/c1-11(2)4-3-9-18-14-8-7-13(16)15(17-14)19-10-12-5-6-12/h7-8,11-12H,3-6,9-10,16H2,1-2H3
InChIKeyJXKLDNGVIICJDJ-UHFFFAOYSA-N
XLogP3.27
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethoxy)-6-(4-methylpentoxy)pyridin-3-amine?
The IUPAC name of 2-(cyclopropylmethoxy)-6-(4-methylpentoxy)pyridin-3-amine (CID 43262521) is 2-(cyclopropylmethoxy)-6-(4-methylpentoxy)pyridin-3-amine.
What is the SMILES notation for 2-(cyclopropylmethoxy)-6-(4-methylpentoxy)pyridin-3-amine?
The canonical SMILES for 2-(cyclopropylmethoxy)-6-(4-methylpentoxy)pyridin-3-amine is CC(C)CCCOc1ccc(N)c(OCC2CC2)n1.
What is the InChIKey of 2-(cyclopropylmethoxy)-6-(4-methylpentoxy)pyridin-3-amine?
The InChIKey is JXKLDNGVIICJDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-11(2)4-3-9-18-14-8-7-13(16)15(17-14)19-10-12-5-6-12/h7-8,11-12H,3-6,9-10,16H2,1-2H3.
What are the key properties of 2-(cyclopropylmethoxy)-6-(4-methylpentoxy)pyridin-3-amine?
2-(cyclopropylmethoxy)-6-(4-methylpentoxy)pyridin-3-amine has a molecular weight of 264.37 g/mol, XLogP of 3.27, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethoxy)-6-(4-methylpentoxy)pyridin-3-amine is sourced from PubChem (CID 43262521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).