2-methyl-7-pyrrolidin-1-yl-2,3-dihydro-1H-indole

C13H18N2 — CID 105454725

IUPAC2-methyl-7-pyrrolidin-1-yl-2,3-dihydro-1H-indole
SMILESCC1Cc2cccc(N3CCCC3)c2N1
InChIInChI=1S/C13H18N2/c1-10-9-11-5-4-6-12(13(11)14-10)15-7-2-3-8-15/h4-6,10,14H,2-3,7-9H2,1H3
InChIKeyMAQZIFWVIZDZCF-UHFFFAOYSA-N
MW202.30 g/mol
LogP2.64
Rot. Bonds1

About 2-methyl-7-pyrrolidin-1-yl-2,3-dihydro-1H-indole

2-methyl-7-pyrrolidin-1-yl-2,3-dihydro-1H-indole (PubChem CID 105454725) has the molecular formula C13H18N2 and a molecular weight of 202.30 g/mol. Its IUPAC name is 2-methyl-7-pyrrolidin-1-yl-2,3-dihydro-1H-indole.

Molecular Properties

Compound Name2-methyl-7-pyrrolidin-1-yl-2,3-dihydro-1H-indole
PubChem CID105454725
Molecular FormulaC13H18N2
Molecular Weight202.30 g/mol
Exact Mass202.15
IUPAC Name2-methyl-7-pyrrolidin-1-yl-2,3-dihydro-1H-indole
SMILESCC1Cc2cccc(N3CCCC3)c2N1
InChIInChI=1S/C13H18N2/c1-10-9-11-5-4-6-12(13(11)14-10)15-7-2-3-8-15/h4-6,10,14H,2-3,7-9H2,1H3
InChIKeyMAQZIFWVIZDZCF-UHFFFAOYSA-N
XLogP2.64
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-7-pyrrolidin-1-yl-2,3-dihydro-1H-indole?
The IUPAC name of 2-methyl-7-pyrrolidin-1-yl-2,3-dihydro-1H-indole (CID 105454725) is 2-methyl-7-pyrrolidin-1-yl-2,3-dihydro-1H-indole.
What is the SMILES notation for 2-methyl-7-pyrrolidin-1-yl-2,3-dihydro-1H-indole?
The canonical SMILES for 2-methyl-7-pyrrolidin-1-yl-2,3-dihydro-1H-indole is CC1Cc2cccc(N3CCCC3)c2N1.
What is the InChIKey of 2-methyl-7-pyrrolidin-1-yl-2,3-dihydro-1H-indole?
The InChIKey is MAQZIFWVIZDZCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2/c1-10-9-11-5-4-6-12(13(11)14-10)15-7-2-3-8-15/h4-6,10,14H,2-3,7-9H2,1H3.
What are the key properties of 2-methyl-7-pyrrolidin-1-yl-2,3-dihydro-1H-indole?
2-methyl-7-pyrrolidin-1-yl-2,3-dihydro-1H-indole has a molecular weight of 202.30 g/mol, XLogP of 2.64, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-7-pyrrolidin-1-yl-2,3-dihydro-1H-indole is sourced from PubChem (CID 105454725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).