2-N-ethyl-2-N-(furan-2-ylmethyl)-6-(2-methylpropoxy)pyridine-2,5-diamine

C16H23N3O2 — CID 61423455

IUPAC2-N-ethyl-2-N-(furan-2-ylmethyl)-6-(2-methylpropoxy)pyridine-2,5-diamine
SMILESCCN(Cc1ccco1)c1ccc(N)c(OCC(C)C)n1
InChIInChI=1S/C16H23N3O2/c1-4-19(10-13-6-5-9-20-13)15-8-7-14(17)16(18-15)21-11-12(2)3/h5-9,12H,4,10-11,17H2,1-3H3
InChIKeyFJPKOYCXONYFTG-UHFFFAOYSA-N
MW289.38 g/mol
LogP3.32
Rot. Bonds7

About 2-N-ethyl-2-N-(furan-2-ylmethyl)-6-(2-methylpropoxy)pyridine-2,5-diamine

2-N-ethyl-2-N-(furan-2-ylmethyl)-6-(2-methylpropoxy)pyridine-2,5-diamine (PubChem CID 61423455) has the molecular formula C16H23N3O2 and a molecular weight of 289.38 g/mol. Its IUPAC name is 2-N-ethyl-2-N-(furan-2-ylmethyl)-6-(2-methylpropoxy)pyridine-2,5-diamine.

Molecular Properties

Compound Name2-N-ethyl-2-N-(furan-2-ylmethyl)-6-(2-methylpropoxy)pyridine-2,5-diamine
PubChem CID61423455
Molecular FormulaC16H23N3O2
Molecular Weight289.38 g/mol
Exact Mass289.18
IUPAC Name2-N-ethyl-2-N-(furan-2-ylmethyl)-6-(2-methylpropoxy)pyridine-2,5-diamine
SMILESCCN(Cc1ccco1)c1ccc(N)c(OCC(C)C)n1
InChIInChI=1S/C16H23N3O2/c1-4-19(10-13-6-5-9-20-13)15-8-7-14(17)16(18-15)21-11-12(2)3/h5-9,12H,4,10-11,17H2,1-3H3
InChIKeyFJPKOYCXONYFTG-UHFFFAOYSA-N
XLogP3.32
TPSA64.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-N-ethyl-2-N-(furan-2-ylmethyl)-6-(2-methylpropoxy)pyridine-2,5-diamine?
The IUPAC name of 2-N-ethyl-2-N-(furan-2-ylmethyl)-6-(2-methylpropoxy)pyridine-2,5-diamine (CID 61423455) is 2-N-ethyl-2-N-(furan-2-ylmethyl)-6-(2-methylpropoxy)pyridine-2,5-diamine.
What is the SMILES notation for 2-N-ethyl-2-N-(furan-2-ylmethyl)-6-(2-methylpropoxy)pyridine-2,5-diamine?
The canonical SMILES for 2-N-ethyl-2-N-(furan-2-ylmethyl)-6-(2-methylpropoxy)pyridine-2,5-diamine is CCN(Cc1ccco1)c1ccc(N)c(OCC(C)C)n1.
What is the InChIKey of 2-N-ethyl-2-N-(furan-2-ylmethyl)-6-(2-methylpropoxy)pyridine-2,5-diamine?
The InChIKey is FJPKOYCXONYFTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O2/c1-4-19(10-13-6-5-9-20-13)15-8-7-14(17)16(18-15)21-11-12(2)3/h5-9,12H,4,10-11,17H2,1-3H3.
What are the key properties of 2-N-ethyl-2-N-(furan-2-ylmethyl)-6-(2-methylpropoxy)pyridine-2,5-diamine?
2-N-ethyl-2-N-(furan-2-ylmethyl)-6-(2-methylpropoxy)pyridine-2,5-diamine has a molecular weight of 289.38 g/mol, XLogP of 3.32, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-ethyl-2-N-(furan-2-ylmethyl)-6-(2-methylpropoxy)pyridine-2,5-diamine is sourced from PubChem (CID 61423455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).