3-(1-methylpiperidin-4-yl)-N-(5,6,7,8-tetrahydronaphthalen-2-yl)-1-tri(propan-2-yl)silylindol-6-amine

C33H49N3Si — CID 58512385

IUPAC3-(1-methylpiperidin-4-yl)-N-(5,6,7,8-tetrahydronaphthalen-2-yl)-1-tri(propan-2-yl)silylindol-6-amine
SMILESCC(C)[Si](C(C)C)(C(C)C)n1cc(C2CCN(C)CC2)c2ccc(Nc3ccc4c(c3)CCCC4)cc21
InChIInChI=1S/C33H49N3Si/c1-23(2)37(24(3)4,25(5)6)36-22-32(27-16-18-35(7)19-17-27)31-15-14-30(21-33(31)36)34-29-13-12-26-10-8-9-11-28(26)20-29/h12-15,20-25,27,34H,8-11,16-19H2,1-7H3
InChIKeyUZMCSZMOARZIPF-UHFFFAOYSA-N
MW515.86 g/mol
LogP9.10
Rot. Bonds7

About 3-(1-methylpiperidin-4-yl)-N-(5,6,7,8-tetrahydronaphthalen-2-yl)-1-tri(propan-2-yl)silylindol-6-amine

3-(1-methylpiperidin-4-yl)-N-(5,6,7,8-tetrahydronaphthalen-2-yl)-1-tri(propan-2-yl)silylindol-6-amine (PubChem CID 58512385) has the molecular formula C33H49N3Si and a molecular weight of 515.86 g/mol. Its IUPAC name is 3-(1-methylpiperidin-4-yl)-N-(5,6,7,8-tetrahydronaphthalen-2-yl)-1-tri(propan-2-yl)silylindol-6-amine.

Molecular Properties

Compound Name3-(1-methylpiperidin-4-yl)-N-(5,6,7,8-tetrahydronaphthalen-2-yl)-1-tri(propan-2-yl)silylindol-6-amine
PubChem CID58512385
Molecular FormulaC33H49N3Si
Molecular Weight515.86 g/mol
Exact Mass515.37
IUPAC Name3-(1-methylpiperidin-4-yl)-N-(5,6,7,8-tetrahydronaphthalen-2-yl)-1-tri(propan-2-yl)silylindol-6-amine
SMILESCC(C)[Si](C(C)C)(C(C)C)n1cc(C2CCN(C)CC2)c2ccc(Nc3ccc4c(c3)CCCC4)cc21
InChIInChI=1S/C33H49N3Si/c1-23(2)37(24(3)4,25(5)6)36-22-32(27-16-18-35(7)19-17-27)31-15-14-30(21-33(31)36)34-29-13-12-26-10-8-9-11-28(26)20-29/h12-15,20-25,27,34H,8-11,16-19H2,1-7H3
InChIKeyUZMCSZMOARZIPF-UHFFFAOYSA-N
XLogP9.10
TPSA20.20 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms37
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500515.86
LogP ≤ 59.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

tert-butyl 4-[5-[[3-(1-methylpiperidin-4-yl)-1-tri(propan-2-yl)silylindol-6-yl]amino]-1-tri(propan-2-yl)silylindol-3-yl]piperidine-1-carboxylate
CID 58512509
6-bromo-1-methyl-3-(1-methylpiperidin-4-yl)indole
CID 58512228
1-methylphosphanyl-3-(1-methylpiperidin-4-yl)indol-6-amine
CID 138711170
N-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,3-dihydro-2-benzofuran-5-amine
CID 144987166
4-(1-methylpiperidin-4-yl)-N-[3-(1-methylpiperidin-4-yl)-1H-indol-6-yl]-1,2-dihydroquinolin-7-amine
CID 138711421
N-[3-(1,1-dimethylpiperidin-1-ium-4-yl)-1-methylindol-6-yl]-1,3-benzoxazol-5-amine
CID 123878892
N-(2,3-dihydro-1H-inden-5-yl)-6-methylimidazo[2,1-b][1,3,4]thiadiazol-2-amine
CID 47140342
N,1-dimethyl-3-[1-(5-propan-2-ylpyrimidin-2-yl)piperidin-4-yl]indol-5-amine
CID 135234997
tert-butyl 4-[6-bromo-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-3-yl]piperidine-1-carboxylate
CID 58512046
N-(2,3-dihydro-1H-inden-5-yl)-1-methylimidazol-2-amine
CID 106557683
N-(2,3-dihydro-1H-inden-5-yl)-4-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine
CID 114009766
6-fluoro-1-methyl-3-(1-propylpiperidin-4-yl)indole
CID 71457837

Frequently Asked Questions

What is the IUPAC name of 3-(1-methylpiperidin-4-yl)-N-(5,6,7,8-tetrahydronaphthalen-2-yl)-1-tri(propan-2-yl)silylindol-6-amine?
The IUPAC name of 3-(1-methylpiperidin-4-yl)-N-(5,6,7,8-tetrahydronaphthalen-2-yl)-1-tri(propan-2-yl)silylindol-6-amine (CID 58512385) is 3-(1-methylpiperidin-4-yl)-N-(5,6,7,8-tetrahydronaphthalen-2-yl)-1-tri(propan-2-yl)silylindol-6-amine.
What is the SMILES notation for 3-(1-methylpiperidin-4-yl)-N-(5,6,7,8-tetrahydronaphthalen-2-yl)-1-tri(propan-2-yl)silylindol-6-amine?
The canonical SMILES for 3-(1-methylpiperidin-4-yl)-N-(5,6,7,8-tetrahydronaphthalen-2-yl)-1-tri(propan-2-yl)silylindol-6-amine is CC(C)[Si](C(C)C)(C(C)C)n1cc(C2CCN(C)CC2)c2ccc(Nc3ccc4c(c3)CCCC4)cc21.
What is the InChIKey of 3-(1-methylpiperidin-4-yl)-N-(5,6,7,8-tetrahydronaphthalen-2-yl)-1-tri(propan-2-yl)silylindol-6-amine?
The InChIKey is UZMCSZMOARZIPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H49N3Si/c1-23(2)37(24(3)4,25(5)6)36-22-32(27-16-18-35(7)19-17-27)31-15-14-30(21-33(31)36)34-29-13-12-26-10-8-9-11-28(26)20-29/h12-15,20-25,27,34H,8-11,16-19H2,1-7H3.
What are the key properties of 3-(1-methylpiperidin-4-yl)-N-(5,6,7,8-tetrahydronaphthalen-2-yl)-1-tri(propan-2-yl)silylindol-6-amine?
3-(1-methylpiperidin-4-yl)-N-(5,6,7,8-tetrahydronaphthalen-2-yl)-1-tri(propan-2-yl)silylindol-6-amine has a molecular weight of 515.86 g/mol, XLogP of 9.10, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-methylpiperidin-4-yl)-N-(5,6,7,8-tetrahydronaphthalen-2-yl)-1-tri(propan-2-yl)silylindol-6-amine is sourced from PubChem (CID 58512385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).