1-[1-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidin-4-yl]-3H-indol-2-one

C23H26N2O — CID 11371415

IUPAC1-[1-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidin-4-yl]-3H-indol-2-one
SMILESO=C1Cc2ccccc2N1C1CCN(C2CCCc3ccccc32)CC1
InChIInChI=1S/C23H26N2O/c26-23-16-18-7-2-4-10-21(18)25(23)19-12-14-24(15-13-19)22-11-5-8-17-6-1-3-9-20(17)22/h1-4,6-7,9-10,19,22H,5,8,11-16H2
InChIKeyVCXYFBSSIJRBFS-UHFFFAOYSA-N
MW346.47 g/mol
LogP4.12
Rot. Bonds2

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

1-[1-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidin-4-yl]-3H-indol-2-one (PubChem CID 11371415) has the molecular formula C23H26N2O and a molecular weight of 346.47 g/mol. Its IUPAC name is 1-[1-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidin-4-yl]-3H-indol-2-one.

Molecular Properties

Compound Name1-[1-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidin-4-yl]-3H-indol-2-one
PubChem CID11371415
Molecular FormulaC23H26N2O
Molecular Weight346.47 g/mol
Exact Mass346.20
IUPAC Name1-[1-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidin-4-yl]-3H-indol-2-one
SMILESO=C1Cc2ccccc2N1C1CCN(C2CCCc3ccccc32)CC1
InChIInChI=1S/C23H26N2O/c26-23-16-18-7-2-4-10-21(18)25(23)19-12-14-24(15-13-19)22-11-5-8-17-6-1-3-9-20(17)22/h1-4,6-7,9-10,19,22H,5,8,11-16H2
InChIKeyVCXYFBSSIJRBFS-UHFFFAOYSA-N
XLogP4.12
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.47
LogP ≤ 54.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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6-[4-(2-methylphenyl)piperazin-1-yl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)hexanamide
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2-[4-(dimethylamino)phenyl]-3H-isoindol-1-one
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2-[3-(dimethylamino)phenyl]-3H-isoindol-1-one
CID 25267377
Phthalimide, N-[4-(4-phenylpiperazin-1-yl)butyl]-
CID 600461
2-[3-(4-Phenyl-piperazin-1-yl)-propyl]-isoindole-1,3-dione
CID 6424809
2-[2-(4-Phenylpiperazin-1-yl)ethyl]isoindole-1,3-dione
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cyclohexyl(2,3-dihydro-1H-indol-1-yl)methanone
CID 701901

Frequently Asked Questions

What is the IUPAC name of 1-[1-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidin-4-yl]-3H-indol-2-one?
The IUPAC name of 1-[1-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidin-4-yl]-3H-indol-2-one (CID 11371415) is 1-[1-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidin-4-yl]-3H-indol-2-one.
What is the SMILES notation for 1-[1-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidin-4-yl]-3H-indol-2-one?
The canonical SMILES for 1-[1-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidin-4-yl]-3H-indol-2-one is O=C1Cc2ccccc2N1C1CCN(C2CCCc3ccccc32)CC1.
What is the InChIKey of 1-[1-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidin-4-yl]-3H-indol-2-one?
The InChIKey is VCXYFBSSIJRBFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N2O/c26-23-16-18-7-2-4-10-21(18)25(23)19-12-14-24(15-13-19)22-11-5-8-17-6-1-3-9-20(17)22/h1-4,6-7,9-10,19,22H,5,8,11-16H2.
What are the key properties of 1-[1-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidin-4-yl]-3H-indol-2-one?
1-[1-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidin-4-yl]-3H-indol-2-one has a molecular weight of 346.47 g/mol, XLogP of 4.12, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidin-4-yl]-3H-indol-2-one is sourced from PubChem (CID 11371415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).