5-[ethyl(methyl)amino]-5,6-dihydro-1,9-phenanthrolin-6-ol

C15H17N3O — CID 126706633

IUPAC5-[ethyl(methyl)amino]-5,6-dihydro-1,9-phenanthrolin-6-ol
SMILESCCN(C)C1c2cccnc2-c2cnccc2C1O
InChIInChI=1S/C15H17N3O/c1-3-18(2)14-11-5-4-7-17-13(11)12-9-16-8-6-10(12)15(14)19/h4-9,14-15,19H,3H2,1-2H3
InChIKeyHIMUAJRPQXLAJJ-UHFFFAOYSA-N
MW255.32 g/mol
LogP2.18
Rot. Bonds2

About 5-[ethyl(methyl)amino]-5,6-dihydro-1,9-phenanthrolin-6-ol

5-[ethyl(methyl)amino]-5,6-dihydro-1,9-phenanthrolin-6-ol (PubChem CID 126706633) has the molecular formula C15H17N3O and a molecular weight of 255.32 g/mol. Its IUPAC name is 5-[ethyl(methyl)amino]-5,6-dihydro-1,9-phenanthrolin-6-ol.

Molecular Properties

Compound Name5-[ethyl(methyl)amino]-5,6-dihydro-1,9-phenanthrolin-6-ol
PubChem CID126706633
Molecular FormulaC15H17N3O
Molecular Weight255.32 g/mol
Exact Mass255.14
IUPAC Name5-[ethyl(methyl)amino]-5,6-dihydro-1,9-phenanthrolin-6-ol
SMILESCCN(C)C1c2cccnc2-c2cnccc2C1O
InChIInChI=1S/C15H17N3O/c1-3-18(2)14-11-5-4-7-17-13(11)12-9-16-8-6-10(12)15(14)19/h4-9,14-15,19H,3H2,1-2H3
InChIKeyHIMUAJRPQXLAJJ-UHFFFAOYSA-N
XLogP2.18
TPSA49.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-[ethyl(methyl)amino]-5,6-dihydro-1,9-phenanthrolin-6-ol?
The IUPAC name of 5-[ethyl(methyl)amino]-5,6-dihydro-1,9-phenanthrolin-6-ol (CID 126706633) is 5-[ethyl(methyl)amino]-5,6-dihydro-1,9-phenanthrolin-6-ol.
What is the SMILES notation for 5-[ethyl(methyl)amino]-5,6-dihydro-1,9-phenanthrolin-6-ol?
The canonical SMILES for 5-[ethyl(methyl)amino]-5,6-dihydro-1,9-phenanthrolin-6-ol is CCN(C)C1c2cccnc2-c2cnccc2C1O.
What is the InChIKey of 5-[ethyl(methyl)amino]-5,6-dihydro-1,9-phenanthrolin-6-ol?
The InChIKey is HIMUAJRPQXLAJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O/c1-3-18(2)14-11-5-4-7-17-13(11)12-9-16-8-6-10(12)15(14)19/h4-9,14-15,19H,3H2,1-2H3.
What are the key properties of 5-[ethyl(methyl)amino]-5,6-dihydro-1,9-phenanthrolin-6-ol?
5-[ethyl(methyl)amino]-5,6-dihydro-1,9-phenanthrolin-6-ol has a molecular weight of 255.32 g/mol, XLogP of 2.18, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[ethyl(methyl)amino]-5,6-dihydro-1,9-phenanthrolin-6-ol is sourced from PubChem (CID 126706633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).