N-[3-(3-methylimidazol-4-yl)-1,7-naphthyridin-6-yl]-2,3-dihydro-1H-isoindole-5-carboxamide

C21H18N6O — CID 138587338

IUPACN-[3-(3-methylimidazol-4-yl)-1,7-naphthyridin-6-yl]-2,3-dihydro-1H-isoindole-5-carboxamide
SMILESCn1cncc1-c1cnc2cnc(NC(=O)c3ccc4c(c3)CNC4)cc2c1
InChIInChI=1S/C21H18N6O/c1-27-12-23-11-19(27)17-5-15-6-20(25-10-18(15)24-9-17)26-21(28)13-2-3-14-7-22-8-16(14)4-13/h2-6,9-12,22H,7-8H2,1H3,(H,25,26,28)
InChIKeyMLWKXZXXXZMPJY-UHFFFAOYSA-N
MW370.42 g/mol
LogP2.89
Rot. Bonds3

About N-[3-(3-methylimidazol-4-yl)-1,7-naphthyridin-6-yl]-2,3-dihydro-1H-isoindole-5-carboxamide

N-[3-(3-methylimidazol-4-yl)-1,7-naphthyridin-6-yl]-2,3-dihydro-1H-isoindole-5-carboxamide (PubChem CID 138587338) has the molecular formula C21H18N6O and a molecular weight of 370.42 g/mol. Its IUPAC name is N-[3-(3-methylimidazol-4-yl)-1,7-naphthyridin-6-yl]-2,3-dihydro-1H-isoindole-5-carboxamide.

Molecular Properties

Compound NameN-[3-(3-methylimidazol-4-yl)-1,7-naphthyridin-6-yl]-2,3-dihydro-1H-isoindole-5-carboxamide
PubChem CID138587338
Molecular FormulaC21H18N6O
Molecular Weight370.42 g/mol
Exact Mass370.15
IUPAC NameN-[3-(3-methylimidazol-4-yl)-1,7-naphthyridin-6-yl]-2,3-dihydro-1H-isoindole-5-carboxamide
SMILESCn1cncc1-c1cnc2cnc(NC(=O)c3ccc4c(c3)CNC4)cc2c1
InChIInChI=1S/C21H18N6O/c1-27-12-23-11-19(27)17-5-15-6-20(25-10-18(15)24-9-17)26-21(28)13-2-3-14-7-22-8-16(14)4-13/h2-6,9-12,22H,7-8H2,1H3,(H,25,26,28)
InChIKeyMLWKXZXXXZMPJY-UHFFFAOYSA-N
XLogP2.89
TPSA84.73 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.42
LogP ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-[3-(3-methylimidazol-4-yl)-1,7-naphthyridin-6-yl]-2,3-dihydro-1H-isoindole-5-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

2-methoxy-N-[3-(3-methylimidazol-4-yl)-1,7-naphthyridin-6-yl]pyridine-4-carboxamide
CID 138590337
2-cyano-N-[3-(3-methylimidazol-4-yl)-1,7-naphthyridin-6-yl]pyridine-4-carboxamide
CID 138586987
N-[3-(3-methylimidazol-4-yl)-1,7-naphthyridin-6-yl]-2-propan-2-yloxyacetamide
CID 138590644
4-methyl-N-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]benzamide
CID 155295664
N-[3-(3-methylimidazol-4-yl)-1,7-naphthyridin-6-yl]-2-(1-methylpyrazol-4-yl)acetamide
CID 138587202
N-[3-(3-methylimidazol-4-yl)-1,7-naphthyridin-6-yl]-3-propan-2-yloxypropanamide
CID 138588532
N-[3-(5-amino-3-pyridinyl)-1,7-naphthyridin-6-yl]-4-fluorobenzamide
CID 138589953
2-(3,3-difluoroazetidin-1-yl)-N-[6-(3-methylimidazol-4-yl)cinnolin-3-yl]pyridine-4-carboxamide
CID 138587728
2,3,5,6-tetradeuterio-N-[6-(3-methylimidazol-4-yl)cinnolin-3-yl]-4-(trideuteriomethoxy)benzamide
CID 138590458
2-(4-methylpiperazin-1-yl)-N-[3-(1-methylpyrazol-3-yl)-1,7-naphthyridin-6-yl]pyridine-4-carboxamide
CID 138587897
N-[1-(2-methyl-1,3-dihydroisoindol-5-yl)ethenyl]-6-(3-methylimidazol-4-yl)isoquinolin-3-amine
CID 166787296
1-ethyl-N-[6-(3-methylimidazol-4-yl)cinnolin-3-yl]pyrazole-4-carboxamide
CID 138587404

Frequently Asked Questions

What is the IUPAC name of N-[3-(3-methylimidazol-4-yl)-1,7-naphthyridin-6-yl]-2,3-dihydro-1H-isoindole-5-carboxamide?
The IUPAC name of N-[3-(3-methylimidazol-4-yl)-1,7-naphthyridin-6-yl]-2,3-dihydro-1H-isoindole-5-carboxamide (CID 138587338) is N-[3-(3-methylimidazol-4-yl)-1,7-naphthyridin-6-yl]-2,3-dihydro-1H-isoindole-5-carboxamide.
What is the SMILES notation for N-[3-(3-methylimidazol-4-yl)-1,7-naphthyridin-6-yl]-2,3-dihydro-1H-isoindole-5-carboxamide?
The canonical SMILES for N-[3-(3-methylimidazol-4-yl)-1,7-naphthyridin-6-yl]-2,3-dihydro-1H-isoindole-5-carboxamide is Cn1cncc1-c1cnc2cnc(NC(=O)c3ccc4c(c3)CNC4)cc2c1.
What is the InChIKey of N-[3-(3-methylimidazol-4-yl)-1,7-naphthyridin-6-yl]-2,3-dihydro-1H-isoindole-5-carboxamide?
The InChIKey is MLWKXZXXXZMPJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N6O/c1-27-12-23-11-19(27)17-5-15-6-20(25-10-18(15)24-9-17)26-21(28)13-2-3-14-7-22-8-16(14)4-13/h2-6,9-12,22H,7-8H2,1H3,(H,25,26,28).
What are the key properties of N-[3-(3-methylimidazol-4-yl)-1,7-naphthyridin-6-yl]-2,3-dihydro-1H-isoindole-5-carboxamide?
N-[3-(3-methylimidazol-4-yl)-1,7-naphthyridin-6-yl]-2,3-dihydro-1H-isoindole-5-carboxamide has a molecular weight of 370.42 g/mol, XLogP of 2.89, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(3-methylimidazol-4-yl)-1,7-naphthyridin-6-yl]-2,3-dihydro-1H-isoindole-5-carboxamide is sourced from PubChem (CID 138587338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).