N-[(4-ethoxyphenyl)methyl]-4-oxo-6-pyrrolidin-1-yl-1H-1,5-naphthyridine-3-carboxamide

C22H24N4O3 — CID 10271820

IUPACN-[(4-ethoxyphenyl)methyl]-4-oxo-6-pyrrolidin-1-yl-1H-1,5-naphthyridine-3-carboxamide
SMILESCCOc1ccc(CNC(=O)c2c[nH]c3ccc(N4CCCC4)nc3c2=O)cc1
InChIInChI=1S/C22H24N4O3/c1-2-29-16-7-5-15(6-8-16)13-24-22(28)17-14-23-18-9-10-19(25-20(18)21(17)27)26-11-3-4-12-26/h5-10,14H,2-4,11-13H2,1H3,(H,23,27)(H,24,28)
InChIKeyJMJOBFIOCRKENI-UHFFFAOYSA-N
MW392.46 g/mol
LogP2.85
Rot. Bonds6

About N-[(4-ethoxyphenyl)methyl]-4-oxo-6-pyrrolidin-1-yl-1H-1,5-naphthyridine-3-carboxamide

N-[(4-ethoxyphenyl)methyl]-4-oxo-6-pyrrolidin-1-yl-1H-1,5-naphthyridine-3-carboxamide (PubChem CID 10271820) has the molecular formula C22H24N4O3 and a molecular weight of 392.46 g/mol. Its IUPAC name is N-[(4-ethoxyphenyl)methyl]-4-oxo-6-pyrrolidin-1-yl-1H-1,5-naphthyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(4-ethoxyphenyl)methyl]-4-oxo-6-pyrrolidin-1-yl-1H-1,5-naphthyridine-3-carboxamide
PubChem CID10271820
Molecular FormulaC22H24N4O3
Molecular Weight392.46 g/mol
Exact Mass392.18
IUPAC NameN-[(4-ethoxyphenyl)methyl]-4-oxo-6-pyrrolidin-1-yl-1H-1,5-naphthyridine-3-carboxamide
SMILESCCOc1ccc(CNC(=O)c2c[nH]c3ccc(N4CCCC4)nc3c2=O)cc1
InChIInChI=1S/C22H24N4O3/c1-2-29-16-7-5-15(6-8-16)13-24-22(28)17-14-23-18-9-10-19(25-20(18)21(17)27)26-11-3-4-12-26/h5-10,14H,2-4,11-13H2,1H3,(H,23,27)(H,24,28)
InChIKeyJMJOBFIOCRKENI-UHFFFAOYSA-N
XLogP2.85
TPSA87.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.46
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[(4-ethoxyphenyl)methyl]-4-oxo-6-pyrrolidin-1-yl-1H-1,5-naphthyridine-3-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

4-oxo-6-pyrrolidin-1-yl-N-(thiophen-2-ylmethyl)-1H-1,5-naphthyridine-3-carboxamide
CID 10108809
N-[[4-[(dimethylamino)methyl]phenyl]methyl]-6-ethoxy-4-oxo-1H-1,5-naphthyridine-3-carboxamide;hydrochloride
CID 10112640
4-oxo-N-[2-oxo-2-[(6-pyrrolidin-1-yl-3-pyridinyl)methylamino]ethyl]-1H-quinoline-3-carboxamide
CID 55702331
2-bromo-N-[(4-chlorophenyl)methyl]-8-oxo-5H-pyrido[3,2-d]pyrimidine-7-carboxamide
CID 22722030
4-acetamido-N-[(4-ethoxyphenyl)methyl]-2-piperidin-1-ylbenzamide
CID 53145952
N-[(4-ethoxyphenyl)methyl]-2-oxo-1H-pyridine-3-carboxamide
CID 46858927
4-(azepan-1-yl)-N-[(4-ethoxyphenyl)methyl]-[1]benzofuro[3,2-d]pyrimidine-2-carboxamide
CID 53108189
N,N'-bis[(4-ethoxyphenyl)methyl]oxamide
CID 125144939
3-[[6-(azepan-1-yl)-3-pyridinyl]methyl]-1-[(4-ethoxyphenyl)methyl]-1-methylurea
CID 55794420
2-(4-ethoxyphenyl)-N-[(4-morpholin-4-ylphenyl)methyl]acetamide
CID 28784276
1-(1H-benzimidazol-2-yl)-N-[(4-ethoxyphenyl)methyl]piperidine-4-carboxamide
CID 6620261
4-ethoxy-N-[[4-[[(4-ethoxybenzoyl)amino]methyl]phenyl]methyl]benzamide
CID 3528873

Frequently Asked Questions

What is the IUPAC name of N-[(4-ethoxyphenyl)methyl]-4-oxo-6-pyrrolidin-1-yl-1H-1,5-naphthyridine-3-carboxamide?
The IUPAC name of N-[(4-ethoxyphenyl)methyl]-4-oxo-6-pyrrolidin-1-yl-1H-1,5-naphthyridine-3-carboxamide (CID 10271820) is N-[(4-ethoxyphenyl)methyl]-4-oxo-6-pyrrolidin-1-yl-1H-1,5-naphthyridine-3-carboxamide.
What is the SMILES notation for N-[(4-ethoxyphenyl)methyl]-4-oxo-6-pyrrolidin-1-yl-1H-1,5-naphthyridine-3-carboxamide?
The canonical SMILES for N-[(4-ethoxyphenyl)methyl]-4-oxo-6-pyrrolidin-1-yl-1H-1,5-naphthyridine-3-carboxamide is CCOc1ccc(CNC(=O)c2c[nH]c3ccc(N4CCCC4)nc3c2=O)cc1.
What is the InChIKey of N-[(4-ethoxyphenyl)methyl]-4-oxo-6-pyrrolidin-1-yl-1H-1,5-naphthyridine-3-carboxamide?
The InChIKey is JMJOBFIOCRKENI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O3/c1-2-29-16-7-5-15(6-8-16)13-24-22(28)17-14-23-18-9-10-19(25-20(18)21(17)27)26-11-3-4-12-26/h5-10,14H,2-4,11-13H2,1H3,(H,23,27)(H,24,28).
What are the key properties of N-[(4-ethoxyphenyl)methyl]-4-oxo-6-pyrrolidin-1-yl-1H-1,5-naphthyridine-3-carboxamide?
N-[(4-ethoxyphenyl)methyl]-4-oxo-6-pyrrolidin-1-yl-1H-1,5-naphthyridine-3-carboxamide has a molecular weight of 392.46 g/mol, XLogP of 2.85, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-ethoxyphenyl)methyl]-4-oxo-6-pyrrolidin-1-yl-1H-1,5-naphthyridine-3-carboxamide is sourced from PubChem (CID 10271820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).