N-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-phenylethyl)pyrazine-2-carboxamide

C25H24N4O3 — CID 649672

IUPACN-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-phenylethyl)pyrazine-2-carboxamide
SMILESCCOc1ccc2[nH]c(=O)c(CN(CCc3ccccc3)C(=O)c3cnccn3)cc2c1
InChIInChI=1S/C25H24N4O3/c1-2-32-21-8-9-22-19(15-21)14-20(24(30)28-22)17-29(13-10-18-6-4-3-5-7-18)25(31)23-16-26-11-12-27-23/h3-9,11-12,14-16H,2,10,13,17H2,1H3,(H,28,30)
InChIKeySUSOQPRNIKSEJR-UHFFFAOYSA-N
MW428.49 g/mol
LogP3.60
Rot. Bonds8

About N-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-phenylethyl)pyrazine-2-carboxamide

N-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-phenylethyl)pyrazine-2-carboxamide (PubChem CID 649672) has the molecular formula C25H24N4O3 and a molecular weight of 428.49 g/mol. Its IUPAC name is N-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-phenylethyl)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-phenylethyl)pyrazine-2-carboxamide
PubChem CID649672
Molecular FormulaC25H24N4O3
Molecular Weight428.49 g/mol
Exact Mass428.18
IUPAC NameN-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-phenylethyl)pyrazine-2-carboxamide
SMILESCCOc1ccc2[nH]c(=O)c(CN(CCc3ccccc3)C(=O)c3cnccn3)cc2c1
InChIInChI=1S/C25H24N4O3/c1-2-32-21-8-9-22-19(15-21)14-20(24(30)28-22)17-29(13-10-18-6-4-3-5-7-18)25(31)23-16-26-11-12-27-23/h3-9,11-12,14-16H,2,10,13,17H2,1H3,(H,28,30)
InChIKeySUSOQPRNIKSEJR-UHFFFAOYSA-N
XLogP3.60
TPSA88.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500428.49
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-phenylethyl)pyrazine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(4-ethoxyphenyl)pyrazine-2-carboxamide
CID 862101
5,6-bis(4-methoxyphenyl)-N-phenylpyrazine-2-carboxamide
CID 10216322
1-(6-Methoxy-2-oxo-1,2-dihydro-quinolin-3-ylmethyl)-3-phenyl-1-pyridin-3-ylmethyl-urea
CID 646408
N-(m-Tolyl)-6-(4-ethoxyphenyl)-pyrazine-2-carboxamide
CID 52947201
N-[2-(4-methoxyphenyl)ethyl]-5-methylpyrazine-2-carboxamide
CID 16552535
N-[2-(3,4-diethoxyphenyl)ethyl]-5-methylpyrazine-2-carboxamide
CID 24687321
N-tert-butyl-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]pyridine-4-carboxamide
CID 664893
N-(2-phenoxyethyl)-5,6-dip-tolylpyrazine-2-carboxamide
CID 11661782
2-Isopropoxy-11-oxo-11H-pyrido[2,1-b]quinazoline-8-carboxylic acid (4-pyridin-3-yl-butyl)-amide
CID 13557474
5-methyl-N-[6-(2-morpholin-4-ylethoxy)quinolin-8-yl]pyrazine-2-carboxamide
CID 124087800
N-[2-(4-methoxyphenyl)ethyl]-2-quinoxalinecarboxamide
CID 9265057
1-(6-Ethoxy-2-oxo-1,2-dihydro-quinolin-3-ylmethyl)-3-(2-methoxy-phenyl)-1-pyridin-3-ylmethyl-urea
CID 649587

Frequently Asked Questions

What is the IUPAC name of N-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-phenylethyl)pyrazine-2-carboxamide?
The IUPAC name of N-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-phenylethyl)pyrazine-2-carboxamide (CID 649672) is N-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-phenylethyl)pyrazine-2-carboxamide.
What is the SMILES notation for N-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-phenylethyl)pyrazine-2-carboxamide?
The canonical SMILES for N-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-phenylethyl)pyrazine-2-carboxamide is CCOc1ccc2[nH]c(=O)c(CN(CCc3ccccc3)C(=O)c3cnccn3)cc2c1.
What is the InChIKey of N-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-phenylethyl)pyrazine-2-carboxamide?
The InChIKey is SUSOQPRNIKSEJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24N4O3/c1-2-32-21-8-9-22-19(15-21)14-20(24(30)28-22)17-29(13-10-18-6-4-3-5-7-18)25(31)23-16-26-11-12-27-23/h3-9,11-12,14-16H,2,10,13,17H2,1H3,(H,28,30).
What are the key properties of N-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-phenylethyl)pyrazine-2-carboxamide?
N-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-phenylethyl)pyrazine-2-carboxamide has a molecular weight of 428.49 g/mol, XLogP of 3.60, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-phenylethyl)pyrazine-2-carboxamide is sourced from PubChem (CID 649672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).