1-(2,3-dimethyl-1H-indol-7-yl)-N,N-dimethylmethanamine

C13H18N2 — CID 124705917

IUPAC1-(2,3-dimethyl-1H-indol-7-yl)-N,N-dimethylmethanamine
SMILESCc1[nH]c2c(CN(C)C)cccc2c1C
InChIInChI=1S/C13H18N2/c1-9-10(2)14-13-11(8-15(3)4)6-5-7-12(9)13/h5-7,14H,8H2,1-4H3
InChIKeyUJODEPZMZFYYBY-UHFFFAOYSA-N
MW202.30 g/mol
LogP2.85
Rot. Bonds2

About 1-(2,3-dimethyl-1H-indol-7-yl)-N,N-dimethylmethanamine

1-(2,3-dimethyl-1H-indol-7-yl)-N,N-dimethylmethanamine (PubChem CID 124705917) has the molecular formula C13H18N2 and a molecular weight of 202.30 g/mol. Its IUPAC name is 1-(2,3-dimethyl-1H-indol-7-yl)-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-(2,3-dimethyl-1H-indol-7-yl)-N,N-dimethylmethanamine
PubChem CID124705917
Molecular FormulaC13H18N2
Molecular Weight202.30 g/mol
Exact Mass202.15
IUPAC Name1-(2,3-dimethyl-1H-indol-7-yl)-N,N-dimethylmethanamine
SMILESCc1[nH]c2c(CN(C)C)cccc2c1C
InChIInChI=1S/C13H18N2/c1-9-10(2)14-13-11(8-15(3)4)6-5-7-12(9)13/h5-7,14H,8H2,1-4H3
InChIKeyUJODEPZMZFYYBY-UHFFFAOYSA-N
XLogP2.85
TPSA19.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dimethyl-1H-indol-7-yl)-N,N-dimethylmethanamine?
The IUPAC name of 1-(2,3-dimethyl-1H-indol-7-yl)-N,N-dimethylmethanamine (CID 124705917) is 1-(2,3-dimethyl-1H-indol-7-yl)-N,N-dimethylmethanamine.
What is the SMILES notation for 1-(2,3-dimethyl-1H-indol-7-yl)-N,N-dimethylmethanamine?
The canonical SMILES for 1-(2,3-dimethyl-1H-indol-7-yl)-N,N-dimethylmethanamine is Cc1[nH]c2c(CN(C)C)cccc2c1C.
What is the InChIKey of 1-(2,3-dimethyl-1H-indol-7-yl)-N,N-dimethylmethanamine?
The InChIKey is UJODEPZMZFYYBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2/c1-9-10(2)14-13-11(8-15(3)4)6-5-7-12(9)13/h5-7,14H,8H2,1-4H3.
What are the key properties of 1-(2,3-dimethyl-1H-indol-7-yl)-N,N-dimethylmethanamine?
1-(2,3-dimethyl-1H-indol-7-yl)-N,N-dimethylmethanamine has a molecular weight of 202.30 g/mol, XLogP of 2.85, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dimethyl-1H-indol-7-yl)-N,N-dimethylmethanamine is sourced from PubChem (CID 124705917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).