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

C15H20N2 — CID 84625643

IUPAC3,4,6-trimethyl-2-pyrrolidin-3-yl-1H-indole
SMILESCc1cc(C)c2c(C)c(C3CCNC3)[nH]c2c1
InChIInChI=1S/C15H20N2/c1-9-6-10(2)14-11(3)15(17-13(14)7-9)12-4-5-16-8-12/h6-7,12,16-17H,4-5,8H2,1-3H3
InChIKeyGNCHMXYDKICSOQ-UHFFFAOYSA-N
MW228.34 g/mol
LogP3.17
Rot. Bonds1

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

3,4,6-trimethyl-2-pyrrolidin-3-yl-1H-indole (PubChem CID 84625643) has the molecular formula C15H20N2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 3,4,6-trimethyl-2-pyrrolidin-3-yl-1H-indole.

Molecular Properties

Compound Name3,4,6-trimethyl-2-pyrrolidin-3-yl-1H-indole
PubChem CID84625643
Molecular FormulaC15H20N2
Molecular Weight228.34 g/mol
Exact Mass228.16
IUPAC Name3,4,6-trimethyl-2-pyrrolidin-3-yl-1H-indole
SMILESCc1cc(C)c2c(C)c(C3CCNC3)[nH]c2c1
InChIInChI=1S/C15H20N2/c1-9-6-10(2)14-11(3)15(17-13(14)7-9)12-4-5-16-8-12/h6-7,12,16-17H,4-5,8H2,1-3H3
InChIKeyGNCHMXYDKICSOQ-UHFFFAOYSA-N
XLogP3.17
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 ≤ 53.17
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-2-yl-1H-indole
CID 84625644
3,6-dimethyl-2-piperidin-4-yl-1H-indole
CID 84625661
4-(2,3,5-trimethylphenyl)piperidine
CID 117292122
3-(2-methoxy-4,6-dimethylphenyl)pyrrolidine
CID 82492093
3,4,7-trimethyl-2-piperidin-3-yl-1H-indole
CID 84630586
3-(3-fluoro-2,5-dimethylphenyl)pyrrolidine
CID 84772855
N,5,7-trimethyl-2,3,4,9-tetrahydro-1H-carbazol-1-amine
CID 65333320
3-(2,4,6-trimethylphenoxy)pyrrolidine
CID 83532626
5,6-difluoro-3-methyl-2-piperidin-3-yl-1H-indole
CID 91174939
3-(3-bromo-2-cyclopropyloxy-5-methylphenyl)pyrrolidine
CID 117477272
6-methyl-2-pyrrolidin-3-yl-1H-imidazo[4,5-b]pyridine
CID 79795877

Frequently Asked Questions

What is the IUPAC name of 3,4,6-trimethyl-2-pyrrolidin-3-yl-1H-indole?
The IUPAC name of 3,4,6-trimethyl-2-pyrrolidin-3-yl-1H-indole (CID 84625643) is 3,4,6-trimethyl-2-pyrrolidin-3-yl-1H-indole.
What is the SMILES notation for 3,4,6-trimethyl-2-pyrrolidin-3-yl-1H-indole?
The canonical SMILES for 3,4,6-trimethyl-2-pyrrolidin-3-yl-1H-indole is Cc1cc(C)c2c(C)c(C3CCNC3)[nH]c2c1.
What is the InChIKey of 3,4,6-trimethyl-2-pyrrolidin-3-yl-1H-indole?
The InChIKey is GNCHMXYDKICSOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2/c1-9-6-10(2)14-11(3)15(17-13(14)7-9)12-4-5-16-8-12/h6-7,12,16-17H,4-5,8H2,1-3H3.
What are the key properties of 3,4,6-trimethyl-2-pyrrolidin-3-yl-1H-indole?
3,4,6-trimethyl-2-pyrrolidin-3-yl-1H-indole has a molecular weight of 228.34 g/mol, XLogP of 3.17, 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-3-yl-1H-indole is sourced from PubChem (CID 84625643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).