2-methyl-2-pyrrolidin-1-ylindole

C13H16N2 — CID 54441439

IUPAC2-methyl-2-pyrrolidin-1-ylindole
SMILESCC1(N2CCCC2)C=c2ccccc2=N1
InChIInChI=1S/C13H16N2/c1-13(15-8-4-5-9-15)10-11-6-2-3-7-12(11)14-13/h2-3,6-7,10H,4-5,8-9H2,1H3
InChIKeyWOJKNWGHFZMPMB-UHFFFAOYSA-N
MW200.29 g/mol
LogP0.91
Rot. Bonds1

About 2-methyl-2-pyrrolidin-1-ylindole

2-methyl-2-pyrrolidin-1-ylindole (PubChem CID 54441439) has the molecular formula C13H16N2 and a molecular weight of 200.29 g/mol. Its IUPAC name is 2-methyl-2-pyrrolidin-1-ylindole.

Molecular Properties

Compound Name2-methyl-2-pyrrolidin-1-ylindole
PubChem CID54441439
Molecular FormulaC13H16N2
Molecular Weight200.29 g/mol
Exact Mass200.13
IUPAC Name2-methyl-2-pyrrolidin-1-ylindole
SMILESCC1(N2CCCC2)C=c2ccccc2=N1
InChIInChI=1S/C13H16N2/c1-13(15-8-4-5-9-15)10-11-6-2-3-7-12(11)14-13/h2-3,6-7,10H,4-5,8-9H2,1H3
InChIKeyWOJKNWGHFZMPMB-UHFFFAOYSA-N
XLogP0.91
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.29
LogP ≤ 50.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Tetrahydropyrrolo[2,1-b]quinazoline
CID 67838209
6,8-dihydro-7-methyl-2H-pyrrolo[3,4-e]benzimidazole
CID 19425983
2-Methyl-2-piperidin-1-ylindole
CID 54111611
1-butyl-3-ethyl-2H-benzimidazole-1,3-diium
CID 57972525
2,3,5,6-tetrahydro-1H-indolizino[8,7-b]indole
CID 141187067
Ethane;3-methyl-5-propan-2-yl-2,3a-dihydrobenzimidazole
CID 143715536
2-[(1E,3Z)-cycloocta-1,3,6-trien-1-yl]-3-(6-methyl-2,3-dihydropyridin-2-yl)-2,3a-dihydrobenzimidazole;ethane
CID 144569188
4-ethyl-N-methyl-6-propan-2-ylidene-3-(pyrrolidin-1-ylmethyl)cyclohexa-2,4-dien-1-imine
CID 169936818
3-methylidene-2,3a-dihydro-1H-pyrrolo[2,1-b]quinazoline
CID 176026377
2-Propan-2-yl-2-pyrrolidin-1-ylbenzimidazole
CID 10105230
2-Methyl-1,2,3,3a-tetrahydropyrrolo[2,1-b]quinazoline
CID 57374606
3-Methyl-5-propan-2-yl-2,3a-dihydrobenzimidazole
CID 143715537

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-pyrrolidin-1-ylindole?
The IUPAC name of 2-methyl-2-pyrrolidin-1-ylindole (CID 54441439) is 2-methyl-2-pyrrolidin-1-ylindole.
What is the SMILES notation for 2-methyl-2-pyrrolidin-1-ylindole?
The canonical SMILES for 2-methyl-2-pyrrolidin-1-ylindole is CC1(N2CCCC2)C=c2ccccc2=N1.
What is the InChIKey of 2-methyl-2-pyrrolidin-1-ylindole?
The InChIKey is WOJKNWGHFZMPMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2/c1-13(15-8-4-5-9-15)10-11-6-2-3-7-12(11)14-13/h2-3,6-7,10H,4-5,8-9H2,1H3.
What are the key properties of 2-methyl-2-pyrrolidin-1-ylindole?
2-methyl-2-pyrrolidin-1-ylindole has a molecular weight of 200.29 g/mol, XLogP of 0.91, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-pyrrolidin-1-ylindole is sourced from PubChem (CID 54441439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).