N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]cyclopropanecarboxamide;1-ethylsulfinylpyrazole

C23H25N7O2S — CID 142447806

IUPACN-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]cyclopropanecarboxamide;1-ethylsulfinylpyrazole
SMILESCCS(=O)n1cccn1.Cc1ccncc1-c1cc2cc(NC(=O)C3CC3)ncc2c(N)n1
InChIInChI=1S/C18H17N5O.C5H8N2OS/c1-10-4-5-20-8-13(10)15-6-12-7-16(23-18(24)11-2-3-11)21-9-14(12)17(19)22-15;1-2-9(8)7-5-3-4-6-7/h4-9,11H,2-3H2,1H3,(H2,19,22)(H,21,23,24);3-5H,2H2,1H3
InChIKeySAIMKIYFTWENEQ-UHFFFAOYSA-N
MW463.57 g/mol
LogP3.35
Rot. Bonds5

About N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]cyclopropanecarboxamide;1-ethylsulfinylpyrazole

N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]cyclopropanecarboxamide;1-ethylsulfinylpyrazole (PubChem CID 142447806) has the molecular formula C23H25N7O2S and a molecular weight of 463.57 g/mol. Its IUPAC name is N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]cyclopropanecarboxamide;1-ethylsulfinylpyrazole.

Molecular Properties

Compound NameN-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]cyclopropanecarboxamide;1-ethylsulfinylpyrazole
PubChem CID142447806
Molecular FormulaC23H25N7O2S
Molecular Weight463.57 g/mol
Exact Mass463.18
IUPAC NameN-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]cyclopropanecarboxamide;1-ethylsulfinylpyrazole
SMILESCCS(=O)n1cccn1.Cc1ccncc1-c1cc2cc(NC(=O)C3CC3)ncc2c(N)n1
InChIInChI=1S/C18H17N5O.C5H8N2OS/c1-10-4-5-20-8-13(10)15-6-12-7-16(23-18(24)11-2-3-11)21-9-14(12)17(19)22-15;1-2-9(8)7-5-3-4-6-7/h4-9,11H,2-3H2,1H3,(H2,19,22)(H,21,23,24);3-5H,2H2,1H3
InChIKeySAIMKIYFTWENEQ-UHFFFAOYSA-N
XLogP3.35
TPSA128.68 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500463.57
LogP ≤ 53.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]cyclopropanecarboxamide;1-ethylsulfinylpyrazole with MolForge

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Related Compounds

(2S)-2-[[6-(2-methylpyrazol-3-yl)-3-pyridinyl]amino]-N-(5-pyridin-3-yl-2-pyridinyl)propanamide
CID 86303027
N-(8-amino-6-(4-methylpyridin-3-yl)-2,7-naphthyridin-3-yl)cyclopropanecarboxamide
CID 135345433
N-(8-(4-(1-Methyl-1H-pyrazol-4-yl)phenyl)-1,6-naphthyridin-2-yl)acetamide
CID 118660815
N-[6-(1-methylpyrazol-4-yl)isoquinolin-3-yl]-1-methylsulfonylpiperidine-4-carboxamide
CID 132056097
1-Isobutyl-N-(6-(1-methyl-1H-pyrazol-4-yl)isoquinolin-3-yl)piperidine-4-carboxamide
CID 132056255
trans-(1R,2R)-N-(1,6-naphthyridin-2-yl)-2-[4-(pyridin-2-ylsulfamoyl)phenyl]cyclopropane-1-carboxamide
CID 162666508
N-[7-(4-methyl-1H-pyrazol-5-yl)isoquinolin-3-yl]cyclopropanecarboxamide
CID 67976201
2-fluoro-N-[7-(4-methyl-3-pyridinyl)-2,6-naphthyridin-3-yl]cyclopropane-1-carboxamide
CID 67976351
N-[7-(4-methyl-3-pyridinyl)-2,6-naphthyridin-3-yl]cyclopropanecarboxamide
CID 68095321
N-[7-(5-fluoro-2-methylphenyl)-5-(1H-pyrazol-4-yl)-2,6-naphthyridin-3-yl]cyclopropanecarboxamide
CID 71115145
(1S,2S)-2-fluoro-N-(7-(4-methylpyridin-3-yl)-2,6-naphthyridin-3-yl)cyclopropanecarboxamide
CID 71115147
N-[7-(5-fluoro-2-methylphenyl)-5-(1-methylpyrazol-4-yl)-2,6-naphthyridin-3-yl]cyclopropanecarboxamide
CID 71115257

Frequently Asked Questions

What is the IUPAC name of N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]cyclopropanecarboxamide;1-ethylsulfinylpyrazole?
The IUPAC name of N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]cyclopropanecarboxamide;1-ethylsulfinylpyrazole (CID 142447806) is N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]cyclopropanecarboxamide;1-ethylsulfinylpyrazole.
What is the SMILES notation for N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]cyclopropanecarboxamide;1-ethylsulfinylpyrazole?
The canonical SMILES for N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]cyclopropanecarboxamide;1-ethylsulfinylpyrazole is CCS(=O)n1cccn1.Cc1ccncc1-c1cc2cc(NC(=O)C3CC3)ncc2c(N)n1.
What is the InChIKey of N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]cyclopropanecarboxamide;1-ethylsulfinylpyrazole?
The InChIKey is SAIMKIYFTWENEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N5O.C5H8N2OS/c1-10-4-5-20-8-13(10)15-6-12-7-16(23-18(24)11-2-3-11)21-9-14(12)17(19)22-15;1-2-9(8)7-5-3-4-6-7/h4-9,11H,2-3H2,1H3,(H2,19,22)(H,21,23,24);3-5H,2H2,1H3.
What are the key properties of N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]cyclopropanecarboxamide;1-ethylsulfinylpyrazole?
N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]cyclopropanecarboxamide;1-ethylsulfinylpyrazole has a molecular weight of 463.57 g/mol, XLogP of 3.35, 5 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]cyclopropanecarboxamide;1-ethylsulfinylpyrazole is sourced from PubChem (CID 142447806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).