(R)-[1-[[5-(6-methoxynaphthalen-2-yl)-1H-pyrazol-4-yl]methyl]piperidin-4-yl]-pyridin-3-ylmethanol

C26H28N4O2 — CID 25274602

IUPAC(R)-[1-[[5-(6-methoxynaphthalen-2-yl)-1H-pyrazol-4-yl]methyl]piperidin-4-yl]-pyridin-3-ylmethanol
SMILESCOc1ccc2cc(-c3[nH]ncc3CN3CCC([C@@H](O)c4cccnc4)CC3)ccc2c1
InChIInChI=1S/C26H28N4O2/c1-32-24-7-6-19-13-21(5-4-20(19)14-24)25-23(16-28-29-25)17-30-11-8-18(9-12-30)26(31)22-3-2-10-27-15-22/h2-7,10,13-16,18,26,31H,8-9,11-12,17H2,1H3,(H,28,29)/t26-/m1/s1
InChIKeyULBMCOAEIWRHQX-AREMUKBSSA-N
MW428.54 g/mol
LogP4.58
Rot. Bonds6

About (R)-[1-[[5-(6-methoxynaphthalen-2-yl)-1H-pyrazol-4-yl]methyl]piperidin-4-yl]-pyridin-3-ylmethanol

(R)-[1-[[5-(6-methoxynaphthalen-2-yl)-1H-pyrazol-4-yl]methyl]piperidin-4-yl]-pyridin-3-ylmethanol (PubChem CID 25274602) has the molecular formula C26H28N4O2 and a molecular weight of 428.54 g/mol. Its IUPAC name is (R)-[1-[[5-(6-methoxynaphthalen-2-yl)-1H-pyrazol-4-yl]methyl]piperidin-4-yl]-pyridin-3-ylmethanol.

Molecular Properties

Compound Name(R)-[1-[[5-(6-methoxynaphthalen-2-yl)-1H-pyrazol-4-yl]methyl]piperidin-4-yl]-pyridin-3-ylmethanol
PubChem CID25274602
Molecular FormulaC26H28N4O2
Molecular Weight428.54 g/mol
Exact Mass428.22
IUPAC Name(R)-[1-[[5-(6-methoxynaphthalen-2-yl)-1H-pyrazol-4-yl]methyl]piperidin-4-yl]-pyridin-3-ylmethanol
SMILESCOc1ccc2cc(-c3[nH]ncc3CN3CCC([C@@H](O)c4cccnc4)CC3)ccc2c1
InChIInChI=1S/C26H28N4O2/c1-32-24-7-6-19-13-21(5-4-20(19)14-24)25-23(16-28-29-25)17-30-11-8-18(9-12-30)26(31)22-3-2-10-27-15-22/h2-7,10,13-16,18,26,31H,8-9,11-12,17H2,1H3,(H,28,29)/t26-/m1/s1
InChIKeyULBMCOAEIWRHQX-AREMUKBSSA-N
XLogP4.58
TPSA74.27 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500428.54
LogP ≤ 54.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze (R)-[1-[[5-(6-methoxynaphthalen-2-yl)-1H-pyrazol-4-yl]methyl]piperidin-4-yl]-pyridin-3-ylmethanol with MolForge

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Related Compounds

4-[1-[[5-(6-methoxynaphthalen-2-yl)-1H-pyrazol-4-yl]methyl]piperidin-4-yl]pyridine
CID 25286681
2-[(2S)-1-[[5-(6-methoxynaphthalen-2-yl)-1H-pyrazol-4-yl]methyl]pyrrolidin-2-yl]pyridine
CID 42193708
2-[[5-(6-methoxynaphthalen-2-yl)-1H-pyrazol-4-yl]methyl-methylamino]-1-phenylethanol
CID 45197233
(R)-[1-[[3-(4-cyclohexylphenyl)-1-methylpyrazol-4-yl]methyl]piperidin-4-yl]-pyridin-3-ylmethanol
CID 25288969
2-[1-[[5-(3-fluorophenyl)-1H-pyrazol-4-yl]methyl]piperidin-4-yl]-2-methoxyacetic acid
CID 166289525
1H-imidazol-2-yl-[1-[(5-phenyl-1H-pyrazol-4-yl)methyl]piperidin-4-yl]methanol
CID 167890120
1-(pyridin-3-ylmethyl)-4-[[5-(3,4,5-trimethoxyphenyl)-1H-pyrazol-4-yl]methyl]piperazine
CID 30723108
(3R,4R)-4-(azepan-1-yl)-1-[[5-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyl]piperidin-3-ol
CID 45241751
4-[4-(3-fluorophenyl)-1H-pyrazol-5-yl]-1-[[5-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyl]piperidine
CID 42431676
2-[2-[1-[[5-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyl]piperidin-4-yl]-4-methyl-1,2-dihydroimidazol-3-yl]ethanol
CID 171780756
7-[[5-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyl]-1-oxa-7-azaspiro[3.5]nonane
CID 135106659
ethyl 2-[4-[[5-(6-methoxynaphthalen-2-yl)-1H-pyrazol-4-yl]methyl]morpholin-3-yl]acetate
CID 45189758

Frequently Asked Questions

What is the IUPAC name of (R)-[1-[[5-(6-methoxynaphthalen-2-yl)-1H-pyrazol-4-yl]methyl]piperidin-4-yl]-pyridin-3-ylmethanol?
The IUPAC name of (R)-[1-[[5-(6-methoxynaphthalen-2-yl)-1H-pyrazol-4-yl]methyl]piperidin-4-yl]-pyridin-3-ylmethanol (CID 25274602) is (R)-[1-[[5-(6-methoxynaphthalen-2-yl)-1H-pyrazol-4-yl]methyl]piperidin-4-yl]-pyridin-3-ylmethanol.
What is the SMILES notation for (R)-[1-[[5-(6-methoxynaphthalen-2-yl)-1H-pyrazol-4-yl]methyl]piperidin-4-yl]-pyridin-3-ylmethanol?
The canonical SMILES for (R)-[1-[[5-(6-methoxynaphthalen-2-yl)-1H-pyrazol-4-yl]methyl]piperidin-4-yl]-pyridin-3-ylmethanol is COc1ccc2cc(-c3[nH]ncc3CN3CCC([C@@H](O)c4cccnc4)CC3)ccc2c1.
What is the InChIKey of (R)-[1-[[5-(6-methoxynaphthalen-2-yl)-1H-pyrazol-4-yl]methyl]piperidin-4-yl]-pyridin-3-ylmethanol?
The InChIKey is ULBMCOAEIWRHQX-AREMUKBSSA-N. The full InChI is InChI=1S/C26H28N4O2/c1-32-24-7-6-19-13-21(5-4-20(19)14-24)25-23(16-28-29-25)17-30-11-8-18(9-12-30)26(31)22-3-2-10-27-15-22/h2-7,10,13-16,18,26,31H,8-9,11-12,17H2,1H3,(H,28,29)/t26-/m1/s1.
What are the key properties of (R)-[1-[[5-(6-methoxynaphthalen-2-yl)-1H-pyrazol-4-yl]methyl]piperidin-4-yl]-pyridin-3-ylmethanol?
(R)-[1-[[5-(6-methoxynaphthalen-2-yl)-1H-pyrazol-4-yl]methyl]piperidin-4-yl]-pyridin-3-ylmethanol has a molecular weight of 428.54 g/mol, XLogP of 4.58, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-[1-[[5-(6-methoxynaphthalen-2-yl)-1H-pyrazol-4-yl]methyl]piperidin-4-yl]-pyridin-3-ylmethanol is sourced from PubChem (CID 25274602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).