N-(7-ethoxy-9-oxo-10H-acridin-3-yl)formamide

C16H14N2O3 — CID 168651298

IUPACN-(7-ethoxy-9-oxo-10H-acridin-3-yl)formamide
SMILESCCOc1ccc2[nH]c3cc(NC=O)ccc3c(=O)c2c1
InChIInChI=1S/C16H14N2O3/c1-2-21-11-4-6-14-13(8-11)16(20)12-5-3-10(17-9-19)7-15(12)18-14/h3-9H,2H2,1H3,(H,17,19)(H,18,20)
InChIKeyMOKLLGGJNRERDK-UHFFFAOYSA-N
MW282.30 g/mol
LogP2.65
Rot. Bonds4

About N-(7-ethoxy-9-oxo-10H-acridin-3-yl)formamide

N-(7-ethoxy-9-oxo-10H-acridin-3-yl)formamide (PubChem CID 168651298) has the molecular formula C16H14N2O3 and a molecular weight of 282.30 g/mol. Its IUPAC name is N-(7-ethoxy-9-oxo-10H-acridin-3-yl)formamide.

Molecular Properties

Compound NameN-(7-ethoxy-9-oxo-10H-acridin-3-yl)formamide
PubChem CID168651298
Molecular FormulaC16H14N2O3
Molecular Weight282.30 g/mol
Exact Mass282.10
IUPAC NameN-(7-ethoxy-9-oxo-10H-acridin-3-yl)formamide
SMILESCCOc1ccc2[nH]c3cc(NC=O)ccc3c(=O)c2c1
InChIInChI=1S/C16H14N2O3/c1-2-21-11-4-6-14-13(8-11)16(20)12-5-3-10(17-9-19)7-15(12)18-14/h3-9H,2H2,1H3,(H,17,19)(H,18,20)
InChIKeyMOKLLGGJNRERDK-UHFFFAOYSA-N
XLogP2.65
TPSA71.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.30
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

2,7-diethoxy-10H-acridin-9-one
CID 163923657
(7-ethoxy-9-oxo-10H-acridin-3-yl)thiourea
CID 169360017
6-(2,3-dihydroxypropylamino)-2-ethoxy-10H-acridin-9-one
CID 168593797
N-(7-ethoxy-9-oxo-10H-acridin-3-yl)-4-methylbenzenesulfonamide
CID 169373409
2,6-bis[3-(ethylamino)propoxy]-10H-acridin-9-one
CID 57439670
2,6-bis[3-(methylamino)propoxy]-10H-acridin-9-one
CID 57439669
6-ethoxy-2-methyl-4-oxo-1H-quinoline-3-carbaldehyde
CID 12594754
2,7-bis[2-(propylamino)ethoxy]-10H-acridin-9-one
CID 57439648
2-[(7-formamido-9H-carbazol-2-yl)oxy]ethoxy thiohypoiodite
CID 143848854
N-(3-ethoxyphenyl)formamide
CID 57236062
2-octoxy-10H-acridin-9-one
CID 611041
N-(7-propan-2-yl-9H-carbazol-2-yl)formamide
CID 89159415

Frequently Asked Questions

What is the IUPAC name of N-(7-ethoxy-9-oxo-10H-acridin-3-yl)formamide?
The IUPAC name of N-(7-ethoxy-9-oxo-10H-acridin-3-yl)formamide (CID 168651298) is N-(7-ethoxy-9-oxo-10H-acridin-3-yl)formamide.
What is the SMILES notation for N-(7-ethoxy-9-oxo-10H-acridin-3-yl)formamide?
The canonical SMILES for N-(7-ethoxy-9-oxo-10H-acridin-3-yl)formamide is CCOc1ccc2[nH]c3cc(NC=O)ccc3c(=O)c2c1.
What is the InChIKey of N-(7-ethoxy-9-oxo-10H-acridin-3-yl)formamide?
The InChIKey is MOKLLGGJNRERDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O3/c1-2-21-11-4-6-14-13(8-11)16(20)12-5-3-10(17-9-19)7-15(12)18-14/h3-9H,2H2,1H3,(H,17,19)(H,18,20).
What are the key properties of N-(7-ethoxy-9-oxo-10H-acridin-3-yl)formamide?
N-(7-ethoxy-9-oxo-10H-acridin-3-yl)formamide has a molecular weight of 282.30 g/mol, XLogP of 2.65, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(7-ethoxy-9-oxo-10H-acridin-3-yl)formamide is sourced from PubChem (CID 168651298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).