2-(4-hydroxypiperidin-1-yl)-N-[7-(1-methylpyrazol-4-yl)quinazolin-2-yl]acetamide

C19H22N6O2 — CID 138587464

IUPAC2-(4-hydroxypiperidin-1-yl)-N-[7-(1-methylpyrazol-4-yl)quinazolin-2-yl]acetamide
SMILESCn1cc(-c2ccc3cnc(NC(=O)CN4CCC(O)CC4)nc3c2)cn1
InChIInChI=1S/C19H22N6O2/c1-24-11-15(10-21-24)13-2-3-14-9-20-19(22-17(14)8-13)23-18(27)12-25-6-4-16(26)5-7-25/h2-3,8-11,16,26H,4-7,12H2,1H3,(H,20,22,23,27)
InChIKeyGFLIHFSMHMFFHH-UHFFFAOYSA-N
MW366.43 g/mol
LogP1.43
Rot. Bonds4

About 2-(4-hydroxypiperidin-1-yl)-N-[7-(1-methylpyrazol-4-yl)quinazolin-2-yl]acetamide

2-(4-hydroxypiperidin-1-yl)-N-[7-(1-methylpyrazol-4-yl)quinazolin-2-yl]acetamide (PubChem CID 138587464) has the molecular formula C19H22N6O2 and a molecular weight of 366.43 g/mol. Its IUPAC name is 2-(4-hydroxypiperidin-1-yl)-N-[7-(1-methylpyrazol-4-yl)quinazolin-2-yl]acetamide.

Molecular Properties

Compound Name2-(4-hydroxypiperidin-1-yl)-N-[7-(1-methylpyrazol-4-yl)quinazolin-2-yl]acetamide
PubChem CID138587464
Molecular FormulaC19H22N6O2
Molecular Weight366.43 g/mol
Exact Mass366.18
IUPAC Name2-(4-hydroxypiperidin-1-yl)-N-[7-(1-methylpyrazol-4-yl)quinazolin-2-yl]acetamide
SMILESCn1cc(-c2ccc3cnc(NC(=O)CN4CCC(O)CC4)nc3c2)cn1
InChIInChI=1S/C19H22N6O2/c1-24-11-15(10-21-24)13-2-3-14-9-20-19(22-17(14)8-13)23-18(27)12-25-6-4-16(26)5-7-25/h2-3,8-11,16,26H,4-7,12H2,1H3,(H,20,22,23,27)
InChIKeyGFLIHFSMHMFFHH-UHFFFAOYSA-N
XLogP1.43
TPSA96.17 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.43
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

2-(6-azaspiro[2.5]octan-6-yl)-N-[7-(1-methylpyrazol-4-yl)quinazolin-2-yl]acetamide
CID 138589175
N-[7-(1-methylpyrazol-4-yl)quinazolin-2-yl]-2-(2,2,5,5-tetradeuteriopyrrolidin-1-yl)acetamide
CID 138587907
2-(4-hydroxypiperidin-1-yl)-N-[2-(1-methylpyrazol-4-yl)-1,6-naphthyridin-7-yl]acetamide
CID 138590290
2-(4-cyclopropylpiperidin-1-yl)-N-[6-(1-methylpyrazol-4-yl)isoquinolin-3-yl]acetamide
CID 155241408
1-(4-methylpiperidin-1-yl)-3-[7-(1-methylpyrazol-4-yl)quinazolin-2-yl]propan-2-one
CID 152879645
(2S)-N-[7-(1-methylpyrazol-4-yl)quinazolin-2-yl]-2-pyrrolidin-1-ylpropanamide
CID 138591844
2-[4-(difluoromethyl)piperidin-1-yl]-N-[2-(1-methylpyrazol-4-yl)-1,6-naphthyridin-7-yl]acetamide
CID 138588097
2-(4-methylpiperidin-1-yl)-N-[6-(1-methylpyrazol-4-yl)cinnolin-3-yl]acetamide
CID 138588375
N-[7-(1-methyltriazol-4-yl)quinazolin-2-yl]-1-(2-pyrrolidin-1-ylacetyl)piperidine-4-carboxamide
CID 138590403
2-[methyl-(1-methylpiperidin-4-yl)amino]-N-[7-(1-methylpyrazol-4-yl)quinazolin-2-yl]pyridine-4-carboxamide
CID 138589294
2-(4-methoxypiperidin-1-yl)-N-[7-(5-methyl-1,3,4-thiadiazol-2-yl)quinazolin-2-yl]acetamide
CID 138589269
N-[7-(1-methylpyrazol-4-yl)quinazolin-2-yl]-1-benzofuran-6-carboxamide
CID 138590788

Frequently Asked Questions

What is the IUPAC name of 2-(4-hydroxypiperidin-1-yl)-N-[7-(1-methylpyrazol-4-yl)quinazolin-2-yl]acetamide?
The IUPAC name of 2-(4-hydroxypiperidin-1-yl)-N-[7-(1-methylpyrazol-4-yl)quinazolin-2-yl]acetamide (CID 138587464) is 2-(4-hydroxypiperidin-1-yl)-N-[7-(1-methylpyrazol-4-yl)quinazolin-2-yl]acetamide.
What is the SMILES notation for 2-(4-hydroxypiperidin-1-yl)-N-[7-(1-methylpyrazol-4-yl)quinazolin-2-yl]acetamide?
The canonical SMILES for 2-(4-hydroxypiperidin-1-yl)-N-[7-(1-methylpyrazol-4-yl)quinazolin-2-yl]acetamide is Cn1cc(-c2ccc3cnc(NC(=O)CN4CCC(O)CC4)nc3c2)cn1.
What is the InChIKey of 2-(4-hydroxypiperidin-1-yl)-N-[7-(1-methylpyrazol-4-yl)quinazolin-2-yl]acetamide?
The InChIKey is GFLIHFSMHMFFHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N6O2/c1-24-11-15(10-21-24)13-2-3-14-9-20-19(22-17(14)8-13)23-18(27)12-25-6-4-16(26)5-7-25/h2-3,8-11,16,26H,4-7,12H2,1H3,(H,20,22,23,27).
What are the key properties of 2-(4-hydroxypiperidin-1-yl)-N-[7-(1-methylpyrazol-4-yl)quinazolin-2-yl]acetamide?
2-(4-hydroxypiperidin-1-yl)-N-[7-(1-methylpyrazol-4-yl)quinazolin-2-yl]acetamide has a molecular weight of 366.43 g/mol, XLogP of 1.43, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-hydroxypiperidin-1-yl)-N-[7-(1-methylpyrazol-4-yl)quinazolin-2-yl]acetamide is sourced from PubChem (CID 138587464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).