N-ethyl-1-(8-methoxyindolizin-1-yl)-N-methylbutan-2-amine

C16H24N2O — CID 169203291

IUPACN-ethyl-1-(8-methoxyindolizin-1-yl)-N-methylbutan-2-amine
SMILESCCC(Cc1ccn2cccc(OC)c12)N(C)CC
InChIInChI=1S/C16H24N2O/c1-5-14(17(3)6-2)12-13-9-11-18-10-7-8-15(19-4)16(13)18/h7-11,14H,5-6,12H2,1-4H3
InChIKeyGEYUTHPHQDLVPQ-UHFFFAOYSA-N
MW260.38 g/mol
LogP3.22
Rot. Bonds6

About N-ethyl-1-(8-methoxyindolizin-1-yl)-N-methylbutan-2-amine

N-ethyl-1-(8-methoxyindolizin-1-yl)-N-methylbutan-2-amine (PubChem CID 169203291) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is N-ethyl-1-(8-methoxyindolizin-1-yl)-N-methylbutan-2-amine.

Molecular Properties

Compound NameN-ethyl-1-(8-methoxyindolizin-1-yl)-N-methylbutan-2-amine
PubChem CID169203291
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC NameN-ethyl-1-(8-methoxyindolizin-1-yl)-N-methylbutan-2-amine
SMILESCCC(Cc1ccn2cccc(OC)c12)N(C)CC
InChIInChI=1S/C16H24N2O/c1-5-14(17(3)6-2)12-13-9-11-18-10-7-8-15(19-4)16(13)18/h7-11,14H,5-6,12H2,1-4H3
InChIKeyGEYUTHPHQDLVPQ-UHFFFAOYSA-N
XLogP3.22
TPSA16.88 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 ≤ 53.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-[ethyl(methyl)amino]propyl]indolizin-8-ol
CID 169202967
N-ethyl-1-(6-fluoroindolizin-1-yl)-N-methylbutan-2-amine
CID 169202930
N-ethyl-1-(8-fluoro-7-methoxyindolizin-1-yl)-N-propan-2-ylbutan-2-amine
CID 169202996
1-[2-(dimethylamino)propyl]indolizin-8-ol
CID 169203335
N-ethyl-1-(7-methoxyindolizin-1-yl)-N-methylpropan-2-amine
CID 169203165
8-methoxyindolizine-1-carboxylic acid
CID 169203127
N-ethyl-2-(8-fluoro-7-methoxyindolizin-1-yl)-N-methylethanamine
CID 169203226
2-N-[1-(2-methoxyphenyl)propan-2-yl]-2-N-methyl-1-N-propan-2-ylbutane-1,2-diamine
CID 65487307
2-amino-1-(8-methoxyindolizin-1-yl)propan-1-one
CID 169203495
N-ethyl-1-(8-fluoroindolizin-1-yl)propan-2-amine
CID 169203514
(1R)-N-ethyl-1-(2-methoxyphenyl)-N-methylethanamine
CID 118327627
3-methoxy-4-[[methyl(pentan-3-yl)amino]methyl]aniline
CID 107208237

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(8-methoxyindolizin-1-yl)-N-methylbutan-2-amine?
The IUPAC name of N-ethyl-1-(8-methoxyindolizin-1-yl)-N-methylbutan-2-amine (CID 169203291) is N-ethyl-1-(8-methoxyindolizin-1-yl)-N-methylbutan-2-amine.
What is the SMILES notation for N-ethyl-1-(8-methoxyindolizin-1-yl)-N-methylbutan-2-amine?
The canonical SMILES for N-ethyl-1-(8-methoxyindolizin-1-yl)-N-methylbutan-2-amine is CCC(Cc1ccn2cccc(OC)c12)N(C)CC.
What is the InChIKey of N-ethyl-1-(8-methoxyindolizin-1-yl)-N-methylbutan-2-amine?
The InChIKey is GEYUTHPHQDLVPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-5-14(17(3)6-2)12-13-9-11-18-10-7-8-15(19-4)16(13)18/h7-11,14H,5-6,12H2,1-4H3.
What are the key properties of N-ethyl-1-(8-methoxyindolizin-1-yl)-N-methylbutan-2-amine?
N-ethyl-1-(8-methoxyindolizin-1-yl)-N-methylbutan-2-amine has a molecular weight of 260.38 g/mol, XLogP of 3.22, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(8-methoxyindolizin-1-yl)-N-methylbutan-2-amine is sourced from PubChem (CID 169203291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).