3-methyl-3-piperidin-4-yl-1,2-dihydroindole

C14H20N2 — CID 142892707

IUPAC3-methyl-3-piperidin-4-yl-1,2-dihydroindole
SMILESCC1(C2CCNCC2)CNc2ccccc21
InChIInChI=1S/C14H20N2/c1-14(11-6-8-15-9-7-11)10-16-13-5-3-2-4-12(13)14/h2-5,11,15-16H,6-10H2,1H3
InChIKeyAOCMXWBPAOWCCO-UHFFFAOYSA-N
MW216.33 g/mol
LogP2.37
Rot. Bonds1

About 3-methyl-3-piperidin-4-yl-1,2-dihydroindole

3-methyl-3-piperidin-4-yl-1,2-dihydroindole (PubChem CID 142892707) has the molecular formula C14H20N2 and a molecular weight of 216.33 g/mol. Its IUPAC name is 3-methyl-3-piperidin-4-yl-1,2-dihydroindole.

Molecular Properties

Compound Name3-methyl-3-piperidin-4-yl-1,2-dihydroindole
PubChem CID142892707
Molecular FormulaC14H20N2
Molecular Weight216.33 g/mol
Exact Mass216.16
IUPAC Name3-methyl-3-piperidin-4-yl-1,2-dihydroindole
SMILESCC1(C2CCNCC2)CNc2ccccc21
InChIInChI=1S/C14H20N2/c1-14(11-6-8-15-9-7-11)10-16-13-5-3-2-4-12(13)14/h2-5,11,15-16H,6-10H2,1H3
InChIKeyAOCMXWBPAOWCCO-UHFFFAOYSA-N
XLogP2.37
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.33
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 146498779
3-iodo-3-methyl-1,2-dihydroindole
CID 166899388
N,N,3-trimethyl-1,2-dihydroindol-3-amine
CID 174390026
(8bS)-8b-methyl-2,3,3a,4-tetrahydro-1H-pyrrolo[2,3-b]indole
CID 141076410
3,3-dimethyl-1,2,4,5-tetrahydro-1,5-benzodiazepine
CID 80503717
2'-methylspiro[1,2-dihydroindole-3,1'-cyclohexane]
CID 58138455
4,6-dimethyl-2,3,4,5-tetrahydro-1H-1-benzazocin-6-amine
CID 146351071
N,N-dimethyl-2-(3-methyl-1,2-dihydroindol-3-yl)ethanamine;ethane
CID 143140765
N-[(3-tert-butyl-1,2-dihydroindol-3-yl)methyl]-N-methylthiohydroxylamine
CID 143386477
ethane;spiro[1,2-dihydroindole-3,1'-cyclohexane]
CID 123637985
(3R)-3-ethyl-3-methyl-1-piperidin-4-ylindol-2-one
CID 86334658
4a-methyl-3,4,9,9a-tetrahydrocarbazole
CID 163544373

Frequently Asked Questions

What is the IUPAC name of 3-methyl-3-piperidin-4-yl-1,2-dihydroindole?
The IUPAC name of 3-methyl-3-piperidin-4-yl-1,2-dihydroindole (CID 142892707) is 3-methyl-3-piperidin-4-yl-1,2-dihydroindole.
What is the SMILES notation for 3-methyl-3-piperidin-4-yl-1,2-dihydroindole?
The canonical SMILES for 3-methyl-3-piperidin-4-yl-1,2-dihydroindole is CC1(C2CCNCC2)CNc2ccccc21.
What is the InChIKey of 3-methyl-3-piperidin-4-yl-1,2-dihydroindole?
The InChIKey is AOCMXWBPAOWCCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2/c1-14(11-6-8-15-9-7-11)10-16-13-5-3-2-4-12(13)14/h2-5,11,15-16H,6-10H2,1H3.
What are the key properties of 3-methyl-3-piperidin-4-yl-1,2-dihydroindole?
3-methyl-3-piperidin-4-yl-1,2-dihydroindole has a molecular weight of 216.33 g/mol, XLogP of 2.37, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-3-piperidin-4-yl-1,2-dihydroindole is sourced from PubChem (CID 142892707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).