N-[7-(1-methylpyrazol-4-yl)quinazolin-2-yl]-2-piperidin-4-yloxypyridine-4-carboxamide

C23H23N7O2 — CID 138587595

IUPACN-[7-(1-methylpyrazol-4-yl)quinazolin-2-yl]-2-piperidin-4-yloxypyridine-4-carboxamide
SMILESCn1cc(-c2ccc3cnc(NC(=O)c4ccnc(OC5CCNCC5)c4)nc3c2)cn1
InChIInChI=1S/C23H23N7O2/c1-30-14-18(13-27-30)15-2-3-17-12-26-23(28-20(17)10-15)29-22(31)16-4-9-25-21(11-16)32-19-5-7-24-8-6-19/h2-4,9-14,19,24H,5-8H2,1H3,(H,26,28,29,31)
InChIKeyXRDPJCJWLNXNFE-UHFFFAOYSA-N
MW429.48 g/mol
LogP2.81
Rot. Bonds5

About N-[7-(1-methylpyrazol-4-yl)quinazolin-2-yl]-2-piperidin-4-yloxypyridine-4-carboxamide

N-[7-(1-methylpyrazol-4-yl)quinazolin-2-yl]-2-piperidin-4-yloxypyridine-4-carboxamide (PubChem CID 138587595) has the molecular formula C23H23N7O2 and a molecular weight of 429.48 g/mol. Its IUPAC name is N-[7-(1-methylpyrazol-4-yl)quinazolin-2-yl]-2-piperidin-4-yloxypyridine-4-carboxamide.

Molecular Properties

Compound NameN-[7-(1-methylpyrazol-4-yl)quinazolin-2-yl]-2-piperidin-4-yloxypyridine-4-carboxamide
PubChem CID138587595
Molecular FormulaC23H23N7O2
Molecular Weight429.48 g/mol
Exact Mass429.19
IUPAC NameN-[7-(1-methylpyrazol-4-yl)quinazolin-2-yl]-2-piperidin-4-yloxypyridine-4-carboxamide
SMILESCn1cc(-c2ccc3cnc(NC(=O)c4ccnc(OC5CCNCC5)c4)nc3c2)cn1
InChIInChI=1S/C23H23N7O2/c1-30-14-18(13-27-30)15-2-3-17-12-26-23(28-20(17)10-15)29-22(31)16-4-9-25-21(11-16)32-19-5-7-24-8-6-19/h2-4,9-14,19,24H,5-8H2,1H3,(H,26,28,29,31)
InChIKeyXRDPJCJWLNXNFE-UHFFFAOYSA-N
XLogP2.81
TPSA106.85 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500429.48
LogP ≤ 52.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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Related Compounds

2-(azetidin-3-yloxy)-N-[7-(1-methylpyrazol-4-yl)quinazolin-2-yl]pyridine-4-carboxamide
CID 138587826
2-[methyl-(1-methylpiperidin-4-yl)amino]-N-[7-(1-methylpyrazol-4-yl)quinazolin-2-yl]pyridine-4-carboxamide
CID 138589294
2-piperidin-4-yloxy-N-[6-(1-propan-2-ylpyrazol-4-yl)isoquinolin-3-yl]pyridine-4-carboxamide
CID 134444263
2-(2,7-diazaspiro[3.5]nonan-7-yl)-N-[7-(1-methylpyrazol-4-yl)quinazolin-2-yl]pyridine-4-carboxamide
CID 138588324
N-[7-(1-methylpyrazol-4-yl)quinazolin-2-yl]-1-benzofuran-6-carboxamide
CID 138590788
2-[2-(dimethylamino)ethylamino]-N-[7-(1-methylpyrazol-4-yl)quinazolin-2-yl]pyridine-4-carboxamide
CID 138587369
N-[3-(1-methylpyrazol-4-yl)-1,7-naphthyridin-6-yl]-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine-4-carboxamide
CID 138588684
2-[4-[6-(4-methylpiperazin-1-yl)pyridine-3-carbonyl]piperazin-1-yl]-N-[7-(1-methylpyrazol-4-yl)quinazolin-2-yl]pyridine-4-carboxamide
CID 138588228
2-(4-hydroxypiperidin-1-yl)-N-[7-(1-methylpyrazol-4-yl)quinazolin-2-yl]acetamide
CID 138587464
(2S)-N-[7-(1-methylpyrazol-4-yl)quinazolin-2-yl]-2-pyrrolidin-1-ylpropanamide
CID 138591844
N-[2-(1-methylpyrazol-4-yl)-1,6-naphthyridin-7-yl]-2-propan-2-yloxypyridine-4-carboxamide
CID 138591594
2-cyclobutyloxy-N-(2-methyl-5-piperidin-4-yl-1,2,4-triazol-3-yl)pyridine-4-carboxamide
CID 120643052

Frequently Asked Questions

What is the IUPAC name of N-[7-(1-methylpyrazol-4-yl)quinazolin-2-yl]-2-piperidin-4-yloxypyridine-4-carboxamide?
The IUPAC name of N-[7-(1-methylpyrazol-4-yl)quinazolin-2-yl]-2-piperidin-4-yloxypyridine-4-carboxamide (CID 138587595) is N-[7-(1-methylpyrazol-4-yl)quinazolin-2-yl]-2-piperidin-4-yloxypyridine-4-carboxamide.
What is the SMILES notation for N-[7-(1-methylpyrazol-4-yl)quinazolin-2-yl]-2-piperidin-4-yloxypyridine-4-carboxamide?
The canonical SMILES for N-[7-(1-methylpyrazol-4-yl)quinazolin-2-yl]-2-piperidin-4-yloxypyridine-4-carboxamide is Cn1cc(-c2ccc3cnc(NC(=O)c4ccnc(OC5CCNCC5)c4)nc3c2)cn1.
What is the InChIKey of N-[7-(1-methylpyrazol-4-yl)quinazolin-2-yl]-2-piperidin-4-yloxypyridine-4-carboxamide?
The InChIKey is XRDPJCJWLNXNFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N7O2/c1-30-14-18(13-27-30)15-2-3-17-12-26-23(28-20(17)10-15)29-22(31)16-4-9-25-21(11-16)32-19-5-7-24-8-6-19/h2-4,9-14,19,24H,5-8H2,1H3,(H,26,28,29,31).
What are the key properties of N-[7-(1-methylpyrazol-4-yl)quinazolin-2-yl]-2-piperidin-4-yloxypyridine-4-carboxamide?
N-[7-(1-methylpyrazol-4-yl)quinazolin-2-yl]-2-piperidin-4-yloxypyridine-4-carboxamide has a molecular weight of 429.48 g/mol, XLogP of 2.81, 5 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[7-(1-methylpyrazol-4-yl)quinazolin-2-yl]-2-piperidin-4-yloxypyridine-4-carboxamide is sourced from PubChem (CID 138587595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).