N-[2-(4-methoxyphenoxy)ethyl]quinoline-8-carboxamide

C19H18N2O3 — CID 51232751

IUPACN-[2-(4-methoxyphenoxy)ethyl]quinoline-8-carboxamide
SMILESCOc1ccc(OCCNC(=O)c2cccc3cccnc23)cc1
InChIInChI=1S/C19H18N2O3/c1-23-15-7-9-16(10-8-15)24-13-12-21-19(22)17-6-2-4-14-5-3-11-20-18(14)17/h2-11H,12-13H2,1H3,(H,21,22)
InChIKeyFFQDFXDLBMPGSW-UHFFFAOYSA-N
MW322.36 g/mol
LogP3.05
Rot. Bonds6

About N-[2-(4-methoxyphenoxy)ethyl]quinoline-8-carboxamide

N-[2-(4-methoxyphenoxy)ethyl]quinoline-8-carboxamide (PubChem CID 51232751) has the molecular formula C19H18N2O3 and a molecular weight of 322.36 g/mol. Its IUPAC name is N-[2-(4-methoxyphenoxy)ethyl]quinoline-8-carboxamide.

Molecular Properties

Compound NameN-[2-(4-methoxyphenoxy)ethyl]quinoline-8-carboxamide
PubChem CID51232751
Molecular FormulaC19H18N2O3
Molecular Weight322.36 g/mol
Exact Mass322.13
IUPAC NameN-[2-(4-methoxyphenoxy)ethyl]quinoline-8-carboxamide
SMILESCOc1ccc(OCCNC(=O)c2cccc3cccnc23)cc1
InChIInChI=1S/C19H18N2O3/c1-23-15-7-9-16(10-8-15)24-13-12-21-19(22)17-6-2-4-14-5-3-11-20-18(14)17/h2-11H,12-13H2,1H3,(H,21,22)
InChIKeyFFQDFXDLBMPGSW-UHFFFAOYSA-N
XLogP3.05
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.36
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(4-methoxyphenoxy)ethyl]-2-quinolin-8-ylacetamide
CID 134036124
6-methoxy-N-(2-methoxyethyl)quinoline-8-carboxamide
CID 175792430
N-[2-(3,4-dimethoxyphenyl)ethyl]quinoline-8-carboxamide
CID 17401154
2-[acetyl(quinolin-8-yl)amino]-N-[2-(4-methoxyphenoxy)ethyl]acetamide
CID 113178693
4-methoxy-N-(2-quinolin-8-ylethyl)benzamide
CID 18149251
N-(2-hydroxy-2-methylpropyl)quinoline-8-carboxamide
CID 65109650
N-[2-(4-methoxyphenoxy)ethyl]pyridine-4-carboxamide
CID 27173434
5-methoxy-2-methyl-N-(2-quinolin-8-yloxyethyl)pyridine-4-carboxamide
CID 146039784
N-[2-[(4-hydroxybenzoyl)amino]ethyl]quinoline-8-carboxamide
CID 60517244
N-[(4-methoxyphenyl)methyl]quinoxaline-5-carboxamide
CID 110701358
N-[2-(3-bromophenoxy)ethyl]-2-methoxypyridine-3-carboxamide
CID 55919722
2,4,5-trimethoxy-N-[2-(4-methoxyphenoxy)ethyl]benzamide
CID 8934968

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-methoxyphenoxy)ethyl]quinoline-8-carboxamide?
The IUPAC name of N-[2-(4-methoxyphenoxy)ethyl]quinoline-8-carboxamide (CID 51232751) is N-[2-(4-methoxyphenoxy)ethyl]quinoline-8-carboxamide.
What is the SMILES notation for N-[2-(4-methoxyphenoxy)ethyl]quinoline-8-carboxamide?
The canonical SMILES for N-[2-(4-methoxyphenoxy)ethyl]quinoline-8-carboxamide is COc1ccc(OCCNC(=O)c2cccc3cccnc23)cc1.
What is the InChIKey of N-[2-(4-methoxyphenoxy)ethyl]quinoline-8-carboxamide?
The InChIKey is FFQDFXDLBMPGSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O3/c1-23-15-7-9-16(10-8-15)24-13-12-21-19(22)17-6-2-4-14-5-3-11-20-18(14)17/h2-11H,12-13H2,1H3,(H,21,22).
What are the key properties of N-[2-(4-methoxyphenoxy)ethyl]quinoline-8-carboxamide?
N-[2-(4-methoxyphenoxy)ethyl]quinoline-8-carboxamide has a molecular weight of 322.36 g/mol, XLogP of 3.05, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-methoxyphenoxy)ethyl]quinoline-8-carboxamide is sourced from PubChem (CID 51232751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).