4-fluoro-N-[6-[1-methyl-5-(pyrrolidin-1-ylmethyl)pyrazol-4-yl]-2,7-naphthyridin-3-yl]benzamide

C24H23FN6O — CID 138588716

IUPAC4-fluoro-N-[6-[1-methyl-5-(pyrrolidin-1-ylmethyl)pyrazol-4-yl]-2,7-naphthyridin-3-yl]benzamide
SMILESCn1ncc(-c2cc3cc(NC(=O)c4ccc(F)cc4)ncc3cn2)c1CN1CCCC1
InChIInChI=1S/C24H23FN6O/c1-30-22(15-31-8-2-3-9-31)20(14-28-30)21-10-17-11-23(27-13-18(17)12-26-21)29-24(32)16-4-6-19(25)7-5-16/h4-7,10-14H,2-3,8-9,15H2,1H3,(H,27,29,32)
InChIKeyQAEFUINYSVFTPL-UHFFFAOYSA-N
MW430.49 g/mol
LogP4.02
Rot. Bonds5

About 4-fluoro-N-[6-[1-methyl-5-(pyrrolidin-1-ylmethyl)pyrazol-4-yl]-2,7-naphthyridin-3-yl]benzamide

4-fluoro-N-[6-[1-methyl-5-(pyrrolidin-1-ylmethyl)pyrazol-4-yl]-2,7-naphthyridin-3-yl]benzamide (PubChem CID 138588716) has the molecular formula C24H23FN6O and a molecular weight of 430.49 g/mol. Its IUPAC name is 4-fluoro-N-[6-[1-methyl-5-(pyrrolidin-1-ylmethyl)pyrazol-4-yl]-2,7-naphthyridin-3-yl]benzamide.

Molecular Properties

Compound Name4-fluoro-N-[6-[1-methyl-5-(pyrrolidin-1-ylmethyl)pyrazol-4-yl]-2,7-naphthyridin-3-yl]benzamide
PubChem CID138588716
Molecular FormulaC24H23FN6O
Molecular Weight430.49 g/mol
Exact Mass430.19
IUPAC Name4-fluoro-N-[6-[1-methyl-5-(pyrrolidin-1-ylmethyl)pyrazol-4-yl]-2,7-naphthyridin-3-yl]benzamide
SMILESCn1ncc(-c2cc3cc(NC(=O)c4ccc(F)cc4)ncc3cn2)c1CN1CCCC1
InChIInChI=1S/C24H23FN6O/c1-30-22(15-31-8-2-3-9-31)20(14-28-30)21-10-17-11-23(27-13-18(17)12-26-21)29-24(32)16-4-6-19(25)7-5-16/h4-7,10-14H,2-3,8-9,15H2,1H3,(H,27,29,32)
InChIKeyQAEFUINYSVFTPL-UHFFFAOYSA-N
XLogP4.02
TPSA75.94 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500430.49
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 4-fluoro-N-[6-[1-methyl-5-(pyrrolidin-1-ylmethyl)pyrazol-4-yl]-2,7-naphthyridin-3-yl]benzamide 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-methyl-N-[6-[1-methyl-5-(piperidin-1-ylmethyl)pyrazol-4-yl]isoquinolin-3-yl]benzamide
CID 157330399
1-benzoyl-N-[6-[1-methyl-5-(piperidin-1-ylmethyl)pyrazol-4-yl]-2,7-naphthyridin-3-yl]piperidine-4-carboxamide
CID 138588479
4-fluoro-N-[6-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-3-yl)-2,7-naphthyridin-3-yl]benzamide
CID 138590649
4-(difluoromethoxy)-N-[6-[5-(hydroxymethyl)-1-methylpyrazol-4-yl]-2,7-naphthyridin-3-yl]benzamide
CID 138587059
1-(4-fluorophenyl)-2-[6-[1-methyl-5-(piperidin-1-ylmethyl)pyrazol-4-yl]isoquinolin-3-yl]ethanone
CID 153123482
N-[6-[5-(hydroxymethyl)-1-methylpyrazol-4-yl]isoquinolin-3-yl]-4-methylbenzamide
CID 160845626
1,4-diethyl-N-[6-[1-methyl-5-(piperidin-1-ylmethyl)pyrazol-4-yl]isoquinolin-3-yl]piperidine-4-carboxamide
CID 166702221
5-N-[6-[5-(2-fluoroethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-3-yl]-2,7-naphthyridin-3-yl]-2-N-methylpyridine-2,5-dicarboxamide
CID 138604994
N-[6-[1-methyl-5-(piperidin-1-ylmethyl)pyrazol-4-yl]isoquinolin-3-yl]-4-(2-methylpropyl)cyclohexane-1-carboxamide
CID 135302487
2-(2-fluoroethyl)-N-[2-[1-methyl-5-(piperidin-1-ylmethyl)pyrazol-4-yl]-1,6-naphthyridin-7-yl]-2-azaspiro[3.3]heptane-6-carboxamide
CID 138590634
1-benzoyl-N-[2-[1-methyl-5-(piperidin-1-ylmethyl)pyrazol-4-yl]-1,6-naphthyridin-7-yl]piperidine-4-carboxamide
CID 138590658
N-[2-[1-methyl-5-(morpholin-4-ylmethyl)pyrazol-4-yl]-1,6-naphthyridin-7-yl]-2-morpholin-4-ylpyridine-4-carboxamide
CID 138589121

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-[6-[1-methyl-5-(pyrrolidin-1-ylmethyl)pyrazol-4-yl]-2,7-naphthyridin-3-yl]benzamide?
The IUPAC name of 4-fluoro-N-[6-[1-methyl-5-(pyrrolidin-1-ylmethyl)pyrazol-4-yl]-2,7-naphthyridin-3-yl]benzamide (CID 138588716) is 4-fluoro-N-[6-[1-methyl-5-(pyrrolidin-1-ylmethyl)pyrazol-4-yl]-2,7-naphthyridin-3-yl]benzamide.
What is the SMILES notation for 4-fluoro-N-[6-[1-methyl-5-(pyrrolidin-1-ylmethyl)pyrazol-4-yl]-2,7-naphthyridin-3-yl]benzamide?
The canonical SMILES for 4-fluoro-N-[6-[1-methyl-5-(pyrrolidin-1-ylmethyl)pyrazol-4-yl]-2,7-naphthyridin-3-yl]benzamide is Cn1ncc(-c2cc3cc(NC(=O)c4ccc(F)cc4)ncc3cn2)c1CN1CCCC1.
What is the InChIKey of 4-fluoro-N-[6-[1-methyl-5-(pyrrolidin-1-ylmethyl)pyrazol-4-yl]-2,7-naphthyridin-3-yl]benzamide?
The InChIKey is QAEFUINYSVFTPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23FN6O/c1-30-22(15-31-8-2-3-9-31)20(14-28-30)21-10-17-11-23(27-13-18(17)12-26-21)29-24(32)16-4-6-19(25)7-5-16/h4-7,10-14H,2-3,8-9,15H2,1H3,(H,27,29,32).
What are the key properties of 4-fluoro-N-[6-[1-methyl-5-(pyrrolidin-1-ylmethyl)pyrazol-4-yl]-2,7-naphthyridin-3-yl]benzamide?
4-fluoro-N-[6-[1-methyl-5-(pyrrolidin-1-ylmethyl)pyrazol-4-yl]-2,7-naphthyridin-3-yl]benzamide has a molecular weight of 430.49 g/mol, XLogP of 4.02, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-[6-[1-methyl-5-(pyrrolidin-1-ylmethyl)pyrazol-4-yl]-2,7-naphthyridin-3-yl]benzamide is sourced from PubChem (CID 138588716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).