1-[4-(2,3-dihydro-1H-indol-6-yl)phenyl]piperidin-2-one

C19H20N2O — CID 174474296

IUPAC1-[4-(2,3-dihydro-1H-indol-6-yl)phenyl]piperidin-2-one
SMILESO=C1CCCCN1c1ccc(-c2ccc3c(c2)NCC3)cc1
InChIInChI=1S/C19H20N2O/c22-19-3-1-2-12-21(19)17-8-6-14(7-9-17)16-5-4-15-10-11-20-18(15)13-16/h4-9,13,20H,1-3,10-12H2
InChIKeyFKILEKIVRBIWMU-UHFFFAOYSA-N
MW292.38 g/mol
LogP3.84
Rot. Bonds2

About 1-[4-(2,3-dihydro-1H-indol-6-yl)phenyl]piperidin-2-one

1-[4-(2,3-dihydro-1H-indol-6-yl)phenyl]piperidin-2-one (PubChem CID 174474296) has the molecular formula C19H20N2O and a molecular weight of 292.38 g/mol. Its IUPAC name is 1-[4-(2,3-dihydro-1H-indol-6-yl)phenyl]piperidin-2-one.

Molecular Properties

Compound Name1-[4-(2,3-dihydro-1H-indol-6-yl)phenyl]piperidin-2-one
PubChem CID174474296
Molecular FormulaC19H20N2O
Molecular Weight292.38 g/mol
Exact Mass292.16
IUPAC Name1-[4-(2,3-dihydro-1H-indol-6-yl)phenyl]piperidin-2-one
SMILESO=C1CCCCN1c1ccc(-c2ccc3c(c2)NCC3)cc1
InChIInChI=1S/C19H20N2O/c22-19-3-1-2-12-21(19)17-8-6-14(7-9-17)16-5-4-15-10-11-20-18(15)13-16/h4-9,13,20H,1-3,10-12H2
InChIKeyFKILEKIVRBIWMU-UHFFFAOYSA-N
XLogP3.84
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[4-(2,3-dihydro-1H-indol-6-yl)phenyl]piperidin-2-one?
The IUPAC name of 1-[4-(2,3-dihydro-1H-indol-6-yl)phenyl]piperidin-2-one (CID 174474296) is 1-[4-(2,3-dihydro-1H-indol-6-yl)phenyl]piperidin-2-one.
What is the SMILES notation for 1-[4-(2,3-dihydro-1H-indol-6-yl)phenyl]piperidin-2-one?
The canonical SMILES for 1-[4-(2,3-dihydro-1H-indol-6-yl)phenyl]piperidin-2-one is O=C1CCCCN1c1ccc(-c2ccc3c(c2)NCC3)cc1.
What is the InChIKey of 1-[4-(2,3-dihydro-1H-indol-6-yl)phenyl]piperidin-2-one?
The InChIKey is FKILEKIVRBIWMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O/c22-19-3-1-2-12-21(19)17-8-6-14(7-9-17)16-5-4-15-10-11-20-18(15)13-16/h4-9,13,20H,1-3,10-12H2.
What are the key properties of 1-[4-(2,3-dihydro-1H-indol-6-yl)phenyl]piperidin-2-one?
1-[4-(2,3-dihydro-1H-indol-6-yl)phenyl]piperidin-2-one has a molecular weight of 292.38 g/mol, XLogP of 3.84, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(2,3-dihydro-1H-indol-6-yl)phenyl]piperidin-2-one is sourced from PubChem (CID 174474296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).