3,4,6-trimethyl-2-pyrrolidin-2-yl-1H-indole

C15H20N2 — CID 84625644

IUPAC3,4,6-trimethyl-2-pyrrolidin-2-yl-1H-indole
SMILESCc1cc(C)c2c(C)c(C3CCCN3)[nH]c2c1
InChIInChI=1S/C15H20N2/c1-9-7-10(2)14-11(3)15(17-13(14)8-9)12-5-4-6-16-12/h7-8,12,16-17H,4-6H2,1-3H3
InChIKeySOGYODTWHUFEQF-UHFFFAOYSA-N
MW228.34 g/mol
LogP3.52
Rot. Bonds1

About 3,4,6-trimethyl-2-pyrrolidin-2-yl-1H-indole

3,4,6-trimethyl-2-pyrrolidin-2-yl-1H-indole (PubChem CID 84625644) has the molecular formula C15H20N2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 3,4,6-trimethyl-2-pyrrolidin-2-yl-1H-indole.

Molecular Properties

Compound Name3,4,6-trimethyl-2-pyrrolidin-2-yl-1H-indole
PubChem CID84625644
Molecular FormulaC15H20N2
Molecular Weight228.34 g/mol
Exact Mass228.16
IUPAC Name3,4,6-trimethyl-2-pyrrolidin-2-yl-1H-indole
SMILESCc1cc(C)c2c(C)c(C3CCCN3)[nH]c2c1
InChIInChI=1S/C15H20N2/c1-9-7-10(2)14-11(3)15(17-13(14)8-9)12-5-4-6-16-12/h7-8,12,16-17H,4-6H2,1-3H3
InChIKeySOGYODTWHUFEQF-UHFFFAOYSA-N
XLogP3.52
TPSA27.82 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 53.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

3,4,6-trimethyl-2-piperidin-4-yl-1H-indole
CID 84630546
3,4,6-trimethyl-2-pyrrolidin-3-yl-1H-indole
CID 84625643
5,7-dimethyl-3-pyrrolidin-2-yl-1H-quinolin-2-one
CID 84630290
3,5-dimethyl-2-[(2S)-pyrrolidin-2-yl]-1H-pyrrole
CID 55293321
3-bromo-6-methyl-2-pyrrolidin-2-yl-1H-indole
CID 84642527
1,3,5,7-tetramethyl-2-pyrrolidin-2-ylindole
CID 84630526
6-fluoro-3-methyl-2-piperidin-2-yl-1H-indole
CID 84627006
N,5,7-trimethyl-2,3,4,9-tetrahydro-1H-carbazol-1-amine
CID 65333320
2-(2,6-dimethoxy-4-methylphenyl)pyrrolidine
CID 130144394
(4,6-dimethyl-1H-indol-3-yl)-pyrrolidin-2-ylmethanone
CID 84630313
2-(7,8-dimethyl-2,3-dihydro-1,4-benzodioxin-5-yl)pyrrolidine
CID 117338806
(2R)-2-(4-methylphenyl)pyrrolidine
CID 7047871

Frequently Asked Questions

What is the IUPAC name of 3,4,6-trimethyl-2-pyrrolidin-2-yl-1H-indole?
The IUPAC name of 3,4,6-trimethyl-2-pyrrolidin-2-yl-1H-indole (CID 84625644) is 3,4,6-trimethyl-2-pyrrolidin-2-yl-1H-indole.
What is the SMILES notation for 3,4,6-trimethyl-2-pyrrolidin-2-yl-1H-indole?
The canonical SMILES for 3,4,6-trimethyl-2-pyrrolidin-2-yl-1H-indole is Cc1cc(C)c2c(C)c(C3CCCN3)[nH]c2c1.
What is the InChIKey of 3,4,6-trimethyl-2-pyrrolidin-2-yl-1H-indole?
The InChIKey is SOGYODTWHUFEQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2/c1-9-7-10(2)14-11(3)15(17-13(14)8-9)12-5-4-6-16-12/h7-8,12,16-17H,4-6H2,1-3H3.
What are the key properties of 3,4,6-trimethyl-2-pyrrolidin-2-yl-1H-indole?
3,4,6-trimethyl-2-pyrrolidin-2-yl-1H-indole has a molecular weight of 228.34 g/mol, XLogP of 3.52, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4,6-trimethyl-2-pyrrolidin-2-yl-1H-indole is sourced from PubChem (CID 84625644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).