5-hydroxy-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide

C21H26N4O2 — CID 126777323

IUPAC5-hydroxy-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide
SMILESCN1CCN(c2ccc(NC(=O)C3CCCc4c(O)cccc43)cn2)CC1
InChIInChI=1S/C21H26N4O2/c1-24-10-12-25(13-11-24)20-9-8-15(14-22-20)23-21(27)18-6-2-5-17-16(18)4-3-7-19(17)26/h3-4,7-9,14,18,26H,2,5-6,10-13H2,1H3,(H,23,27)
InChIKeyOIJDNLVMHVVXIV-UHFFFAOYSA-N
MW366.47 g/mol
LogP2.60
Rot. Bonds3

About 5-hydroxy-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide

5-hydroxy-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide (PubChem CID 126777323) has the molecular formula C21H26N4O2 and a molecular weight of 366.47 g/mol. Its IUPAC name is 5-hydroxy-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide.

Molecular Properties

Compound Name5-hydroxy-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide
PubChem CID126777323
Molecular FormulaC21H26N4O2
Molecular Weight366.47 g/mol
Exact Mass366.21
IUPAC Name5-hydroxy-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide
SMILESCN1CCN(c2ccc(NC(=O)C3CCCc4c(O)cccc43)cn2)CC1
InChIInChI=1S/C21H26N4O2/c1-24-10-12-25(13-11-24)20-9-8-15(14-22-20)23-21(27)18-6-2-5-17-16(18)4-3-7-19(17)26/h3-4,7-9,14,18,26H,2,5-6,10-13H2,1H3,(H,23,27)
InChIKeyOIJDNLVMHVVXIV-UHFFFAOYSA-N
XLogP2.60
TPSA68.70 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.47
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 5-hydroxy-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide with MolForge

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Related Compounds

N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-2,3-dihydro-1-benzofuran-3-carboxamide
CID 167869501
5-hydroxy-N-(2-methyl-6-morpholin-4-yl-3-pyridinyl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide
CID 126794225
2-(2-chlorophenyl)-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]cyclopropane-1-carboxamide
CID 51321278
1-(2,2-dimethylpropanoyl)-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]pyrrolidine-2-carboxamide
CID 55634906
N-[3-methyl-1-[[6-(4-methylpiperazin-1-yl)-3-pyridinyl]amino]-1-oxobutan-2-yl]cyclohexanecarboxamide
CID 24610805
N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]adamantane-1-carboxamide
CID 25396636
N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
CID 18151192
N-(6-morpholin-4-yl-3-pyridinyl)-3,4-dihydro-2H-chromene-4-carboxamide
CID 126784589
1-(4-chlorobenzoyl)-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]piperidine-3-carboxamide
CID 16613341
5-methyl-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]pyrazine-2-carboxamide
CID 30548234
1-(2-fluorophenyl)sulfonyl-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]pyrrolidine-2-carboxamide
CID 24646697
3-(azepan-1-ylsulfonyl)-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]benzamide
CID 24592308

Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide?
The IUPAC name of 5-hydroxy-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide (CID 126777323) is 5-hydroxy-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide.
What is the SMILES notation for 5-hydroxy-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide?
The canonical SMILES for 5-hydroxy-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide is CN1CCN(c2ccc(NC(=O)C3CCCc4c(O)cccc43)cn2)CC1.
What is the InChIKey of 5-hydroxy-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide?
The InChIKey is OIJDNLVMHVVXIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N4O2/c1-24-10-12-25(13-11-24)20-9-8-15(14-22-20)23-21(27)18-6-2-5-17-16(18)4-3-7-19(17)26/h3-4,7-9,14,18,26H,2,5-6,10-13H2,1H3,(H,23,27).
What are the key properties of 5-hydroxy-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide?
5-hydroxy-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide has a molecular weight of 366.47 g/mol, XLogP of 2.60, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide is sourced from PubChem (CID 126777323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).