6-(3-diethylphosphorylfuran-2-yl)-3,5-diethylpyridin-2-amine

C17H25N2O2P — CID 141021913

IUPAC6-(3-diethylphosphorylfuran-2-yl)-3,5-diethylpyridin-2-amine
SMILESCCc1cc(CC)c(-c2occc2P(=O)(CC)CC)nc1N
InChIInChI=1S/C17H25N2O2P/c1-5-12-11-13(6-2)17(18)19-15(12)16-14(9-10-21-16)22(20,7-3)8-4/h9-11H,5-8H2,1-4H3,(H2,18,19)
InChIKeyDANNQRXTQWJKMK-UHFFFAOYSA-N
MW320.37 g/mol
LogP4.08
Rot. Bonds6

About 6-(3-diethylphosphorylfuran-2-yl)-3,5-diethylpyridin-2-amine

6-(3-diethylphosphorylfuran-2-yl)-3,5-diethylpyridin-2-amine (PubChem CID 141021913) has the molecular formula C17H25N2O2P and a molecular weight of 320.37 g/mol. Its IUPAC name is 6-(3-diethylphosphorylfuran-2-yl)-3,5-diethylpyridin-2-amine.

Molecular Properties

Compound Name6-(3-diethylphosphorylfuran-2-yl)-3,5-diethylpyridin-2-amine
PubChem CID141021913
Molecular FormulaC17H25N2O2P
Molecular Weight320.37 g/mol
Exact Mass320.17
IUPAC Name6-(3-diethylphosphorylfuran-2-yl)-3,5-diethylpyridin-2-amine
SMILESCCc1cc(CC)c(-c2occc2P(=O)(CC)CC)nc1N
InChIInChI=1S/C17H25N2O2P/c1-5-12-11-13(6-2)17(18)19-15(12)16-14(9-10-21-16)22(20,7-3)8-4/h9-11H,5-8H2,1-4H3,(H2,18,19)
InChIKeyDANNQRXTQWJKMK-UHFFFAOYSA-N
XLogP4.08
TPSA69.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.37
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

[2-(5-ethyl-2-methyl-1,3-thiazol-4-yl)furan-3-yl]phosphonic acid
CID 22280573
[2-(6-amino-3-methylsulfanylpyrazin-2-yl)furan-3-yl]phosphonic acid
CID 22280443
3,8-diethylquinolin-2-amine
CID 17039687
3-diethylphosphoryl-2-(1,3-dithian-2-yl)furan
CID 141022035
[2-[2-amino-5-(hydroxymethyl)-1,3-thiazol-4-yl]furan-3-yl]phosphonic acid
CID 22280638
3,8-diethylquinolin-2-amine;hydrochloride
CID 43866005
6-dimethylphosphoryl-3-ethylpyridin-2-amine
CID 176568598
3-ethyl-2-naphthalen-2-ylfuran
CID 173009659
3,6-diethylpyridin-2-amine
CID 119085750
4,6-diethyl-1-benzofuran-7-amine
CID 118074596
6-ethyl-2-(3-methylfuran-2-yl)thieno[2,3-d]pyrimidin-4-amine
CID 104806564
(3-ethylfuran-2-yl)methanethiol
CID 89321498

Frequently Asked Questions

What is the IUPAC name of 6-(3-diethylphosphorylfuran-2-yl)-3,5-diethylpyridin-2-amine?
The IUPAC name of 6-(3-diethylphosphorylfuran-2-yl)-3,5-diethylpyridin-2-amine (CID 141021913) is 6-(3-diethylphosphorylfuran-2-yl)-3,5-diethylpyridin-2-amine.
What is the SMILES notation for 6-(3-diethylphosphorylfuran-2-yl)-3,5-diethylpyridin-2-amine?
The canonical SMILES for 6-(3-diethylphosphorylfuran-2-yl)-3,5-diethylpyridin-2-amine is CCc1cc(CC)c(-c2occc2P(=O)(CC)CC)nc1N.
What is the InChIKey of 6-(3-diethylphosphorylfuran-2-yl)-3,5-diethylpyridin-2-amine?
The InChIKey is DANNQRXTQWJKMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N2O2P/c1-5-12-11-13(6-2)17(18)19-15(12)16-14(9-10-21-16)22(20,7-3)8-4/h9-11H,5-8H2,1-4H3,(H2,18,19).
What are the key properties of 6-(3-diethylphosphorylfuran-2-yl)-3,5-diethylpyridin-2-amine?
6-(3-diethylphosphorylfuran-2-yl)-3,5-diethylpyridin-2-amine has a molecular weight of 320.37 g/mol, XLogP of 4.08, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-diethylphosphorylfuran-2-yl)-3,5-diethylpyridin-2-amine is sourced from PubChem (CID 141021913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).