(2R)-1-(1H-inden-2-yl)-2-methylpyrrolidine

C14H17N — CID 134854074

IUPAC(2R)-1-(1H-inden-2-yl)-2-methylpyrrolidine
SMILESC[C@@H]1CCCN1C1=Cc2ccccc2C1
InChIInChI=1S/C14H17N/c1-11-5-4-8-15(11)14-9-12-6-2-3-7-13(12)10-14/h2-3,6-7,9,11H,4-5,8,10H2,1H3/t11-/m1/s1
InChIKeyMGFBTVMBLSPLRJ-LLVKDONJSA-N
MW199.30 g/mol
LogP3.07
Rot. Bonds1

About (2R)-1-(1H-inden-2-yl)-2-methylpyrrolidine

(2R)-1-(1H-inden-2-yl)-2-methylpyrrolidine (PubChem CID 134854074) has the molecular formula C14H17N and a molecular weight of 199.30 g/mol. Its IUPAC name is (2R)-1-(1H-inden-2-yl)-2-methylpyrrolidine.

Molecular Properties

Compound Name(2R)-1-(1H-inden-2-yl)-2-methylpyrrolidine
PubChem CID134854074
Molecular FormulaC14H17N
Molecular Weight199.30 g/mol
Exact Mass199.14
IUPAC Name(2R)-1-(1H-inden-2-yl)-2-methylpyrrolidine
SMILESC[C@@H]1CCCN1C1=Cc2ccccc2C1
InChIInChI=1S/C14H17N/c1-11-5-4-8-15(11)14-9-12-6-2-3-7-13(12)10-14/h2-3,6-7,9,11H,4-5,8,10H2,1H3/t11-/m1/s1
InChIKeyMGFBTVMBLSPLRJ-LLVKDONJSA-N
XLogP3.07
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.30
LogP ≤ 53.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (2R)-1-(1H-inden-2-yl)-2-methylpyrrolidine?
The IUPAC name of (2R)-1-(1H-inden-2-yl)-2-methylpyrrolidine (CID 134854074) is (2R)-1-(1H-inden-2-yl)-2-methylpyrrolidine.
What is the SMILES notation for (2R)-1-(1H-inden-2-yl)-2-methylpyrrolidine?
The canonical SMILES for (2R)-1-(1H-inden-2-yl)-2-methylpyrrolidine is C[C@@H]1CCCN1C1=Cc2ccccc2C1.
What is the InChIKey of (2R)-1-(1H-inden-2-yl)-2-methylpyrrolidine?
The InChIKey is MGFBTVMBLSPLRJ-LLVKDONJSA-N. The full InChI is InChI=1S/C14H17N/c1-11-5-4-8-15(11)14-9-12-6-2-3-7-13(12)10-14/h2-3,6-7,9,11H,4-5,8,10H2,1H3/t11-/m1/s1.
What are the key properties of (2R)-1-(1H-inden-2-yl)-2-methylpyrrolidine?
(2R)-1-(1H-inden-2-yl)-2-methylpyrrolidine has a molecular weight of 199.30 g/mol, XLogP of 3.07, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-(1H-inden-2-yl)-2-methylpyrrolidine is sourced from PubChem (CID 134854074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).