(4-fluorophenyl)-[4-(1H-indol-2-yl)piperidin-1-yl]methanone

C20H19FN2O — CID 113087831

IUPAC(4-fluorophenyl)-[4-(1H-indol-2-yl)piperidin-1-yl]methanone
SMILESO=C(c1ccc(F)cc1)N1CCC(c2cc3ccccc3[nH]2)CC1
InChIInChI=1S/C20H19FN2O/c21-17-7-5-15(6-8-17)20(24)23-11-9-14(10-12-23)19-13-16-3-1-2-4-18(16)22-19/h1-8,13-14,22H,9-12H2
InChIKeyUESHVZFODHINGG-UHFFFAOYSA-N
MW322.38 g/mol
LogP4.33
Rot. Bonds2

About (4-fluorophenyl)-[4-(1H-indol-2-yl)piperidin-1-yl]methanone

(4-fluorophenyl)-[4-(1H-indol-2-yl)piperidin-1-yl]methanone (PubChem CID 113087831) has the molecular formula C20H19FN2O and a molecular weight of 322.38 g/mol. Its IUPAC name is (4-fluorophenyl)-[4-(1H-indol-2-yl)piperidin-1-yl]methanone.

Molecular Properties

Compound Name(4-fluorophenyl)-[4-(1H-indol-2-yl)piperidin-1-yl]methanone
PubChem CID113087831
Molecular FormulaC20H19FN2O
Molecular Weight322.38 g/mol
Exact Mass322.15
IUPAC Name(4-fluorophenyl)-[4-(1H-indol-2-yl)piperidin-1-yl]methanone
SMILESO=C(c1ccc(F)cc1)N1CCC(c2cc3ccccc3[nH]2)CC1
InChIInChI=1S/C20H19FN2O/c21-17-7-5-15(6-8-17)20(24)23-11-9-14(10-12-23)19-13-16-3-1-2-4-18(16)22-19/h1-8,13-14,22H,9-12H2
InChIKeyUESHVZFODHINGG-UHFFFAOYSA-N
XLogP4.33
TPSA36.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.38
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

[4-(5-fluoro-1H-indol-2-yl)piperidin-1-yl]-(4-fluorophenyl)methanone
CID 113088126
(3,4-difluorophenyl)-[3-(1H-indol-2-yl)pyrrolidin-1-yl]methanone
CID 113088344
furan-2-yl-[4-(1H-indol-2-yl)piperidin-1-yl]methanone
CID 113087824
[2-(dimethylamino)-4-pyridinyl]-[4-(1H-indol-2-yl)piperidin-1-yl]methanone
CID 51097128
2-(2-fluorophenyl)-1-[4-(1H-indol-2-yl)piperidin-1-yl]ethanone
CID 113087860
(3-fluorophenyl)-[4-(5-methyl-1H-indol-2-yl)piperidin-1-yl]methanone
CID 113088033
(2-hydroxy-4-methylphenyl)-[4-(1H-indol-2-yl)piperidin-1-yl]methanone
CID 139011392
(4-fluorophenyl)-[3-(1H-pyrrolo[3,2-b]pyridin-2-yl)pyrrolidin-1-yl]methanone
CID 155512824
[3-(1H-indol-2-yl)pyrrolidin-1-yl]-pyridin-3-ylmethanone
CID 113088338
(3-fluorophenyl)-[4-(5-methoxy-1H-indol-2-yl)piperidin-1-yl]methanone
CID 113088227
(4-fluorophenyl)-[4-(1-methylindol-2-yl)piperidin-1-yl]methanone
CID 113087934
[3-(1H-indol-2-yl)pyrrolidin-1-yl]-(3,4,5-trimethoxyphenyl)methanone
CID 113088321

Frequently Asked Questions

What is the IUPAC name of (4-fluorophenyl)-[4-(1H-indol-2-yl)piperidin-1-yl]methanone?
The IUPAC name of (4-fluorophenyl)-[4-(1H-indol-2-yl)piperidin-1-yl]methanone (CID 113087831) is (4-fluorophenyl)-[4-(1H-indol-2-yl)piperidin-1-yl]methanone.
What is the SMILES notation for (4-fluorophenyl)-[4-(1H-indol-2-yl)piperidin-1-yl]methanone?
The canonical SMILES for (4-fluorophenyl)-[4-(1H-indol-2-yl)piperidin-1-yl]methanone is O=C(c1ccc(F)cc1)N1CCC(c2cc3ccccc3[nH]2)CC1.
What is the InChIKey of (4-fluorophenyl)-[4-(1H-indol-2-yl)piperidin-1-yl]methanone?
The InChIKey is UESHVZFODHINGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19FN2O/c21-17-7-5-15(6-8-17)20(24)23-11-9-14(10-12-23)19-13-16-3-1-2-4-18(16)22-19/h1-8,13-14,22H,9-12H2.
What are the key properties of (4-fluorophenyl)-[4-(1H-indol-2-yl)piperidin-1-yl]methanone?
(4-fluorophenyl)-[4-(1H-indol-2-yl)piperidin-1-yl]methanone has a molecular weight of 322.38 g/mol, XLogP of 4.33, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-fluorophenyl)-[4-(1H-indol-2-yl)piperidin-1-yl]methanone is sourced from PubChem (CID 113087831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).