3-(1-methylpyrrolidin-3-yl)-1H-indole

C13H16N2 — CID 19337

IUPAC3-(1-methylpyrrolidin-3-yl)-1H-indole
SMILESCN1CCC(c2c[nH]c3ccccc23)C1
InChIInChI=1S/C13H16N2/c1-15-7-6-10(9-15)12-8-14-13-5-3-2-4-11(12)13/h2-5,8,10,14H,6-7,9H2,1H3
InChIKeyGIUCRWSFDBHBDT-UHFFFAOYSA-N
MW200.29 g/mol
LogP2.59
Rot. Bonds1

About 3-(1-methylpyrrolidin-3-yl)-1H-indole

3-(1-methylpyrrolidin-3-yl)-1H-indole (PubChem CID 19337) has the molecular formula C13H16N2 and a molecular weight of 200.29 g/mol. Its IUPAC name is 3-(1-methylpyrrolidin-3-yl)-1H-indole.

Molecular Properties

Compound Name3-(1-methylpyrrolidin-3-yl)-1H-indole
PubChem CID19337
Molecular FormulaC13H16N2
Molecular Weight200.29 g/mol
Exact Mass200.13
IUPAC Name3-(1-methylpyrrolidin-3-yl)-1H-indole
SMILESCN1CCC(c2c[nH]c3ccccc23)C1
InChIInChI=1S/C13H16N2/c1-15-7-6-10(9-15)12-8-14-13-5-3-2-4-11(12)13/h2-5,8,10,14H,6-7,9H2,1H3
InChIKeyGIUCRWSFDBHBDT-UHFFFAOYSA-N
XLogP2.59
TPSA19.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.29
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-(1-methylpiperidin-4-yl)-1H-indole;dihydrochloride
CID 174560357
5-bromo-3-(1-methylpyrrolidin-3-yl)-1H-indole
CID 15326275
N-ethyl-4-(1H-indol-3-yl)-N-(1-methylpiperidin-4-yl)piperidin-1-amine
CID 143927617
3-(1-butylpiperidin-4-yl)-1H-indole
CID 21135948
3-[(1R,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl]-1H-indole
CID 10037310
2-[4-(1H-indol-3-yl)piperidin-1-yl]ethanethiol
CID 116997210
3-(1-propan-2-ylsulfanylpiperidin-4-yl)-1H-indole
CID 144855106
3-[1-(2-methylphenyl)piperidin-4-yl]-1H-indole
CID 91802123
ethyl 3-(1H-indol-3-yl)pyrrolidine-1-carboxylate
CID 110711039
3-[1-(benzenesulfonyl)pyrrolidin-3-yl]-1H-indole
CID 110711055
[3-(1H-indol-3-yl)pyrrolidin-1-yl]-(2-methylphenyl)methanone
CID 70686769
ethane;3-piperidin-4-yl-1H-indole
CID 91036207

Frequently Asked Questions

What is the IUPAC name of 3-(1-methylpyrrolidin-3-yl)-1H-indole?
The IUPAC name of 3-(1-methylpyrrolidin-3-yl)-1H-indole (CID 19337) is 3-(1-methylpyrrolidin-3-yl)-1H-indole.
What is the SMILES notation for 3-(1-methylpyrrolidin-3-yl)-1H-indole?
The canonical SMILES for 3-(1-methylpyrrolidin-3-yl)-1H-indole is CN1CCC(c2c[nH]c3ccccc23)C1.
What is the InChIKey of 3-(1-methylpyrrolidin-3-yl)-1H-indole?
The InChIKey is GIUCRWSFDBHBDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2/c1-15-7-6-10(9-15)12-8-14-13-5-3-2-4-11(12)13/h2-5,8,10,14H,6-7,9H2,1H3.
What are the key properties of 3-(1-methylpyrrolidin-3-yl)-1H-indole?
3-(1-methylpyrrolidin-3-yl)-1H-indole has a molecular weight of 200.29 g/mol, XLogP of 2.59, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-methylpyrrolidin-3-yl)-1H-indole is sourced from PubChem (CID 19337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).