9-amino-5-ethylphenanthridin-6-one

C15H14N2O — CID 10399308

IUPAC9-amino-5-ethylphenanthridin-6-one
SMILESCCn1c(=O)c2ccc(N)cc2c2ccccc21
InChIInChI=1S/C15H14N2O/c1-2-17-14-6-4-3-5-11(14)13-9-10(16)7-8-12(13)15(17)18/h3-9H,2,16H2,1H3
InChIKeyFLXMSMBWHMPFLM-UHFFFAOYSA-N
MW238.29 g/mol
LogP2.76
Rot. Bonds1

About 9-amino-5-ethylphenanthridin-6-one

9-amino-5-ethylphenanthridin-6-one (PubChem CID 10399308) has the molecular formula C15H14N2O and a molecular weight of 238.29 g/mol. Its IUPAC name is 9-amino-5-ethylphenanthridin-6-one.

Molecular Properties

Compound Name9-amino-5-ethylphenanthridin-6-one
PubChem CID10399308
Molecular FormulaC15H14N2O
Molecular Weight238.29 g/mol
Exact Mass238.11
IUPAC Name9-amino-5-ethylphenanthridin-6-one
SMILESCCn1c(=O)c2ccc(N)cc2c2ccccc21
InChIInChI=1S/C15H14N2O/c1-2-17-14-6-4-3-5-11(14)13-9-10(16)7-8-12(13)15(17)18/h3-9H,2,16H2,1H3
InChIKeyFLXMSMBWHMPFLM-UHFFFAOYSA-N
XLogP2.76
TPSA48.02 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Related Compounds

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2-amino-5-(methoxymethyl)phenanthridin-6-one
CID 82371155
2-(2-amino-6-oxophenanthridin-5-yl)acetamide
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6-amino-9-ethyl-3-phenyl-[1,3]oxazino[6,5-b]indole-2,4-dione
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CID 66915381
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ethyl 3-(3-aminocarbazol-9-yl)propanoate
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Frequently Asked Questions

What is the IUPAC name of 9-amino-5-ethylphenanthridin-6-one?
The IUPAC name of 9-amino-5-ethylphenanthridin-6-one (CID 10399308) is 9-amino-5-ethylphenanthridin-6-one.
What is the SMILES notation for 9-amino-5-ethylphenanthridin-6-one?
The canonical SMILES for 9-amino-5-ethylphenanthridin-6-one is CCn1c(=O)c2ccc(N)cc2c2ccccc21.
What is the InChIKey of 9-amino-5-ethylphenanthridin-6-one?
The InChIKey is FLXMSMBWHMPFLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O/c1-2-17-14-6-4-3-5-11(14)13-9-10(16)7-8-12(13)15(17)18/h3-9H,2,16H2,1H3.
What are the key properties of 9-amino-5-ethylphenanthridin-6-one?
9-amino-5-ethylphenanthridin-6-one has a molecular weight of 238.29 g/mol, XLogP of 2.76, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-amino-5-ethylphenanthridin-6-one is sourced from PubChem (CID 10399308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).