1-[4-(1H-indazol-3-yl)-2-pyridinyl]-4-pyridin-2-ylpiperidin-4-ol

C22H21N5O — CID 85473220

IUPAC1-[4-(1H-indazol-3-yl)-2-pyridinyl]-4-pyridin-2-ylpiperidin-4-ol
SMILESOC1(c2ccccn2)CCN(c2cc(-c3n[nH]c4ccccc34)ccn2)CC1
InChIInChI=1S/C22H21N5O/c28-22(19-7-3-4-11-23-19)9-13-27(14-10-22)20-15-16(8-12-24-20)21-17-5-1-2-6-18(17)25-26-21/h1-8,11-12,15,28H,9-10,13-14H2,(H,25,26)
InChIKeyNSYCPXNPSXBFOZ-UHFFFAOYSA-N
MW371.44 g/mol
LogP3.51
Rot. Bonds3

About 1-[4-(1H-indazol-3-yl)-2-pyridinyl]-4-pyridin-2-ylpiperidin-4-ol

1-[4-(1H-indazol-3-yl)-2-pyridinyl]-4-pyridin-2-ylpiperidin-4-ol (PubChem CID 85473220) has the molecular formula C22H21N5O and a molecular weight of 371.44 g/mol. Its IUPAC name is 1-[4-(1H-indazol-3-yl)-2-pyridinyl]-4-pyridin-2-ylpiperidin-4-ol.

Molecular Properties

Compound Name1-[4-(1H-indazol-3-yl)-2-pyridinyl]-4-pyridin-2-ylpiperidin-4-ol
PubChem CID85473220
Molecular FormulaC22H21N5O
Molecular Weight371.44 g/mol
Exact Mass371.17
IUPAC Name1-[4-(1H-indazol-3-yl)-2-pyridinyl]-4-pyridin-2-ylpiperidin-4-ol
SMILESOC1(c2ccccn2)CCN(c2cc(-c3n[nH]c4ccccc34)ccn2)CC1
InChIInChI=1S/C22H21N5O/c28-22(19-7-3-4-11-23-19)9-13-27(14-10-22)20-15-16(8-12-24-20)21-17-5-1-2-6-18(17)25-26-21/h1-8,11-12,15,28H,9-10,13-14H2,(H,25,26)
InChIKeyNSYCPXNPSXBFOZ-UHFFFAOYSA-N
XLogP3.51
TPSA77.93 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.44
LogP ≤ 53.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 1-[4-(1H-indazol-3-yl)-2-pyridinyl]-4-pyridin-2-ylpiperidin-4-ol with MolForge

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Launch Full Analysis

Related Compounds

(1R)-1-[7-[(2-fluoranyl-4-pyrazol-1-yl-phenyl)amino]-1,6-naphthyridin-2-yl]-1-(1-methylpiperidin-4-yl)ethanol
CID 162439820
(1R)-1-[7-[2-fluoro-4-[3-(hydroxymethyl)pyrazol-1-yl]anilino]-1,6-naphthyridin-2-yl]-1-(1-methylpiperidin-4-yl)ethanol
CID 166631508
3-(2-morpholin-4-yl-4-pyridinyl)-N-(oxan-4-yl)-1H-pyrazolo[4,3-c]pyridin-4-amine
CID 56940771
4-(4-(1H-indazol-3-yl)pyridin-2-yl)morpholine
CID 85472857
4-[4-(5-pyridazin-3-yl-1H-indazol-3-yl)-2-pyridinyl]morpholine
CID 90400634
1-(2-hydroxy-1-phenylethyl)-3-[3-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]pyridin-6-yl]urea
CID 71555248
1-[(1S)-2-hydroxy-1-phenylethyl]-3-[3-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]pyridin-6-yl]urea
CID 71555318
3-[6-[6-(6-Methylpyrazin-2-yl)pyrazolo[4,3-c]pyridin-1-yl]-2-pyridinyl]piperidin-3-ol
CID 72714951
1-[(S)-(1-hydroxycyclopentyl)-phenylmethyl]-3-[3-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]pyridin-6-yl]urea
CID 89536165
1-[(1S)-2-hydroxy-1-phenylethyl]-3-(3-pyridin-4-yl-1H-pyrazolo[4,3-c]pyridin-6-yl)urea
CID 92044837
(1S)-1-(4-fluorophenyl)-1-[2-[4-[6-(1H-pyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-4-yl]piperazin-1-yl]pyrimidin-5-yl]ethanol
CID 118032866
(1S)-1-(2,4-difluorophenyl)-1-[2-[4-[6-(1H-pyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-4-yl]piperazin-1-yl]pyrimidin-5-yl]ethanol
CID 118032890

Frequently Asked Questions

What is the IUPAC name of 1-[4-(1H-indazol-3-yl)-2-pyridinyl]-4-pyridin-2-ylpiperidin-4-ol?
The IUPAC name of 1-[4-(1H-indazol-3-yl)-2-pyridinyl]-4-pyridin-2-ylpiperidin-4-ol (CID 85473220) is 1-[4-(1H-indazol-3-yl)-2-pyridinyl]-4-pyridin-2-ylpiperidin-4-ol.
What is the SMILES notation for 1-[4-(1H-indazol-3-yl)-2-pyridinyl]-4-pyridin-2-ylpiperidin-4-ol?
The canonical SMILES for 1-[4-(1H-indazol-3-yl)-2-pyridinyl]-4-pyridin-2-ylpiperidin-4-ol is OC1(c2ccccn2)CCN(c2cc(-c3n[nH]c4ccccc34)ccn2)CC1.
What is the InChIKey of 1-[4-(1H-indazol-3-yl)-2-pyridinyl]-4-pyridin-2-ylpiperidin-4-ol?
The InChIKey is NSYCPXNPSXBFOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N5O/c28-22(19-7-3-4-11-23-19)9-13-27(14-10-22)20-15-16(8-12-24-20)21-17-5-1-2-6-18(17)25-26-21/h1-8,11-12,15,28H,9-10,13-14H2,(H,25,26).
What are the key properties of 1-[4-(1H-indazol-3-yl)-2-pyridinyl]-4-pyridin-2-ylpiperidin-4-ol?
1-[4-(1H-indazol-3-yl)-2-pyridinyl]-4-pyridin-2-ylpiperidin-4-ol has a molecular weight of 371.44 g/mol, XLogP of 3.51, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(1H-indazol-3-yl)-2-pyridinyl]-4-pyridin-2-ylpiperidin-4-ol is sourced from PubChem (CID 85473220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).