5-(2-piperidin-1-yl-4-pyridinyl)-1H-indole

C18H19N3 — CID 175773336

IUPAC5-(2-piperidin-1-yl-4-pyridinyl)-1H-indole
SMILESc1cc(-c2ccc3[nH]ccc3c2)cc(N2CCCCC2)n1
InChIInChI=1S/C18H19N3/c1-2-10-21(11-3-1)18-13-15(6-9-20-18)14-4-5-17-16(12-14)7-8-19-17/h4-9,12-13,19H,1-3,10-11H2
InChIKeyYYYGREKTCZUIJJ-UHFFFAOYSA-N
MW277.37 g/mol
LogP4.22
Rot. Bonds2

About 5-(2-piperidin-1-yl-4-pyridinyl)-1H-indole

5-(2-piperidin-1-yl-4-pyridinyl)-1H-indole (PubChem CID 175773336) has the molecular formula C18H19N3 and a molecular weight of 277.37 g/mol. Its IUPAC name is 5-(2-piperidin-1-yl-4-pyridinyl)-1H-indole.

Molecular Properties

Compound Name5-(2-piperidin-1-yl-4-pyridinyl)-1H-indole
PubChem CID175773336
Molecular FormulaC18H19N3
Molecular Weight277.37 g/mol
Exact Mass277.16
IUPAC Name5-(2-piperidin-1-yl-4-pyridinyl)-1H-indole
SMILESc1cc(-c2ccc3[nH]ccc3c2)cc(N2CCCCC2)n1
InChIInChI=1S/C18H19N3/c1-2-10-21(11-3-1)18-13-15(6-9-20-18)14-4-5-17-16(12-14)7-8-19-17/h4-9,12-13,19H,1-3,10-11H2
InChIKeyYYYGREKTCZUIJJ-UHFFFAOYSA-N
XLogP4.22
TPSA31.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(2-piperidin-1-yl-4-pyridinyl)-1H-indole?
The IUPAC name of 5-(2-piperidin-1-yl-4-pyridinyl)-1H-indole (CID 175773336) is 5-(2-piperidin-1-yl-4-pyridinyl)-1H-indole.
What is the SMILES notation for 5-(2-piperidin-1-yl-4-pyridinyl)-1H-indole?
The canonical SMILES for 5-(2-piperidin-1-yl-4-pyridinyl)-1H-indole is c1cc(-c2ccc3[nH]ccc3c2)cc(N2CCCCC2)n1.
What is the InChIKey of 5-(2-piperidin-1-yl-4-pyridinyl)-1H-indole?
The InChIKey is YYYGREKTCZUIJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3/c1-2-10-21(11-3-1)18-13-15(6-9-20-18)14-4-5-17-16(12-14)7-8-19-17/h4-9,12-13,19H,1-3,10-11H2.
What are the key properties of 5-(2-piperidin-1-yl-4-pyridinyl)-1H-indole?
5-(2-piperidin-1-yl-4-pyridinyl)-1H-indole has a molecular weight of 277.37 g/mol, XLogP of 4.22, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-piperidin-1-yl-4-pyridinyl)-1H-indole is sourced from PubChem (CID 175773336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).