2-(5-methoxy-1-propylindol-3-yl)-N,N-dimethylethanamine

C16H24N2O — CID 10777767

IUPAC2-(5-methoxy-1-propylindol-3-yl)-N,N-dimethylethanamine
SMILESCCCn1cc(CCN(C)C)c2cc(OC)ccc21
InChIInChI=1S/C16H24N2O/c1-5-9-18-12-13(8-10-17(2)3)15-11-14(19-4)6-7-16(15)18/h6-7,11-12H,5,8-10H2,1-4H3
InChIKeyFEIKMSDMCKNQCS-UHFFFAOYSA-N
MW260.38 g/mol
LogP3.16
Rot. Bonds6

About 2-(5-methoxy-1-propylindol-3-yl)-N,N-dimethylethanamine

2-(5-methoxy-1-propylindol-3-yl)-N,N-dimethylethanamine (PubChem CID 10777767) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 2-(5-methoxy-1-propylindol-3-yl)-N,N-dimethylethanamine.

Molecular Properties

Compound Name2-(5-methoxy-1-propylindol-3-yl)-N,N-dimethylethanamine
PubChem CID10777767
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name2-(5-methoxy-1-propylindol-3-yl)-N,N-dimethylethanamine
SMILESCCCn1cc(CCN(C)C)c2cc(OC)ccc21
InChIInChI=1S/C16H24N2O/c1-5-9-18-12-13(8-10-17(2)3)15-11-14(19-4)6-7-16(15)18/h6-7,11-12H,5,8-10H2,1-4H3
InChIKeyFEIKMSDMCKNQCS-UHFFFAOYSA-N
XLogP3.16
TPSA17.40 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 53.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(5-methoxy-1-propylindol-3-yl)-N,N-dimethylethanamine?
The IUPAC name of 2-(5-methoxy-1-propylindol-3-yl)-N,N-dimethylethanamine (CID 10777767) is 2-(5-methoxy-1-propylindol-3-yl)-N,N-dimethylethanamine.
What is the SMILES notation for 2-(5-methoxy-1-propylindol-3-yl)-N,N-dimethylethanamine?
The canonical SMILES for 2-(5-methoxy-1-propylindol-3-yl)-N,N-dimethylethanamine is CCCn1cc(CCN(C)C)c2cc(OC)ccc21.
What is the InChIKey of 2-(5-methoxy-1-propylindol-3-yl)-N,N-dimethylethanamine?
The InChIKey is FEIKMSDMCKNQCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-5-9-18-12-13(8-10-17(2)3)15-11-14(19-4)6-7-16(15)18/h6-7,11-12H,5,8-10H2,1-4H3.
What are the key properties of 2-(5-methoxy-1-propylindol-3-yl)-N,N-dimethylethanamine?
2-(5-methoxy-1-propylindol-3-yl)-N,N-dimethylethanamine has a molecular weight of 260.38 g/mol, XLogP of 3.16, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methoxy-1-propylindol-3-yl)-N,N-dimethylethanamine is sourced from PubChem (CID 10777767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).