4-[1-[2-(2-methylpyrazol-3-yl)ethyl]piperidin-4-yl]oxy-1H-indole

C19H24N4O — CID 126951673

IUPAC4-[1-[2-(2-methylpyrazol-3-yl)ethyl]piperidin-4-yl]oxy-1H-indole
SMILESCn1nccc1CCN1CCC(Oc2cccc3[nH]ccc23)CC1
InChIInChI=1S/C19H24N4O/c1-22-15(5-11-21-22)7-12-23-13-8-16(9-14-23)24-19-4-2-3-18-17(19)6-10-20-18/h2-6,10-11,16,20H,7-9,12-14H2,1H3
InChIKeyMGQVPAZLZZLVCK-UHFFFAOYSA-N
MW324.43 g/mol
LogP2.99
Rot. Bonds5

About 4-[1-[2-(2-methylpyrazol-3-yl)ethyl]piperidin-4-yl]oxy-1H-indole

4-[1-[2-(2-methylpyrazol-3-yl)ethyl]piperidin-4-yl]oxy-1H-indole (PubChem CID 126951673) has the molecular formula C19H24N4O and a molecular weight of 324.43 g/mol. Its IUPAC name is 4-[1-[2-(2-methylpyrazol-3-yl)ethyl]piperidin-4-yl]oxy-1H-indole.

Molecular Properties

Compound Name4-[1-[2-(2-methylpyrazol-3-yl)ethyl]piperidin-4-yl]oxy-1H-indole
PubChem CID126951673
Molecular FormulaC19H24N4O
Molecular Weight324.43 g/mol
Exact Mass324.20
IUPAC Name4-[1-[2-(2-methylpyrazol-3-yl)ethyl]piperidin-4-yl]oxy-1H-indole
SMILESCn1nccc1CCN1CCC(Oc2cccc3[nH]ccc23)CC1
InChIInChI=1S/C19H24N4O/c1-22-15(5-11-21-22)7-12-23-13-8-16(9-14-23)24-19-4-2-3-18-17(19)6-10-20-18/h2-6,10-11,16,20H,7-9,12-14H2,1H3
InChIKeyMGQVPAZLZZLVCK-UHFFFAOYSA-N
XLogP2.99
TPSA46.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.43
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[1-(2-pyrazol-1-ylethyl)piperidin-4-yl]oxy-1H-indole
CID 126951523
4-[1-[2-(2-methylpyrazol-3-yl)ethyl]piperidin-4-yl]oxy-1-(2,2,2-trifluoroethyl)indole
CID 126952652
4-[[4-(1H-indol-4-yloxy)piperidin-1-yl]methyl]-1,3-oxazole
CID 126951645
1-[2-[4-(1H-indol-4-yloxy)piperidin-1-yl]ethyl]pyrrolidin-2-one
CID 126951691
5-[[4-(1H-indol-4-yloxy)piperidin-1-yl]methyl]-1-methylpyridin-2-one
CID 126951612
4-[1-(1,4-dioxepan-6-ylmethyl)piperidin-4-yl]oxy-1H-indole
CID 126951709
4-[1-[(5-methylpyrazin-2-yl)methyl]piperidin-4-yl]oxy-1H-indole
CID 126951596
5-[[4-(1H-indol-4-yloxy)piperidin-1-yl]methyl]-1,2,4-oxadiazole
CID 126951620
4-[1-(pyrimidin-4-ylmethyl)piperidin-4-yl]oxy-1H-indole
CID 126951608
4-(2-fluorophenoxy)-1-[(2-methylpyrazol-3-yl)methyl]piperidine
CID 46981140
4-chloro-1-[2-(2-methylpyrazol-3-yl)ethyl]piperidine
CID 103015106
2-[[4-(1H-indol-4-yloxy)piperidin-1-yl]methyl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine
CID 126951577

Frequently Asked Questions

What is the IUPAC name of 4-[1-[2-(2-methylpyrazol-3-yl)ethyl]piperidin-4-yl]oxy-1H-indole?
The IUPAC name of 4-[1-[2-(2-methylpyrazol-3-yl)ethyl]piperidin-4-yl]oxy-1H-indole (CID 126951673) is 4-[1-[2-(2-methylpyrazol-3-yl)ethyl]piperidin-4-yl]oxy-1H-indole.
What is the SMILES notation for 4-[1-[2-(2-methylpyrazol-3-yl)ethyl]piperidin-4-yl]oxy-1H-indole?
The canonical SMILES for 4-[1-[2-(2-methylpyrazol-3-yl)ethyl]piperidin-4-yl]oxy-1H-indole is Cn1nccc1CCN1CCC(Oc2cccc3[nH]ccc23)CC1.
What is the InChIKey of 4-[1-[2-(2-methylpyrazol-3-yl)ethyl]piperidin-4-yl]oxy-1H-indole?
The InChIKey is MGQVPAZLZZLVCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O/c1-22-15(5-11-21-22)7-12-23-13-8-16(9-14-23)24-19-4-2-3-18-17(19)6-10-20-18/h2-6,10-11,16,20H,7-9,12-14H2,1H3.
What are the key properties of 4-[1-[2-(2-methylpyrazol-3-yl)ethyl]piperidin-4-yl]oxy-1H-indole?
4-[1-[2-(2-methylpyrazol-3-yl)ethyl]piperidin-4-yl]oxy-1H-indole has a molecular weight of 324.43 g/mol, XLogP of 2.99, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-[2-(2-methylpyrazol-3-yl)ethyl]piperidin-4-yl]oxy-1H-indole is sourced from PubChem (CID 126951673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).