N-ethyl-1-(8-fluoroindolizin-1-yl)propan-2-amine

C13H17FN2 — CID 169203514

IUPACN-ethyl-1-(8-fluoroindolizin-1-yl)propan-2-amine
SMILESCCNC(C)Cc1ccn2cccc(F)c12
InChIInChI=1S/C13H17FN2/c1-3-15-10(2)9-11-6-8-16-7-4-5-12(14)13(11)16/h4-8,10,15H,3,9H2,1-2H3
InChIKeyCTOKDQKOVZPYKM-UHFFFAOYSA-N
MW220.29 g/mol
LogP2.62
Rot. Bonds4

About N-ethyl-1-(8-fluoroindolizin-1-yl)propan-2-amine

N-ethyl-1-(8-fluoroindolizin-1-yl)propan-2-amine (PubChem CID 169203514) has the molecular formula C13H17FN2 and a molecular weight of 220.29 g/mol. Its IUPAC name is N-ethyl-1-(8-fluoroindolizin-1-yl)propan-2-amine.

Molecular Properties

Compound NameN-ethyl-1-(8-fluoroindolizin-1-yl)propan-2-amine
PubChem CID169203514
Molecular FormulaC13H17FN2
Molecular Weight220.29 g/mol
Exact Mass220.14
IUPAC NameN-ethyl-1-(8-fluoroindolizin-1-yl)propan-2-amine
SMILESCCNC(C)Cc1ccn2cccc(F)c12
InChIInChI=1S/C13H17FN2/c1-3-15-10(2)9-11-6-8-16-7-4-5-12(14)13(11)16/h4-8,10,15H,3,9H2,1-2H3
InChIKeyCTOKDQKOVZPYKM-UHFFFAOYSA-N
XLogP2.62
TPSA16.44 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.29
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(8-fluoroindolizin-1-yl)-N-methylpropan-2-amine
CID 169203506
1-[2-(methylamino)propyl]indolizin-8-ol
CID 169203102
1-(2,4-difluorophenyl)-N-ethylpropan-2-amine
CID 62195914
N-[1-(8-hydroxyindolizin-1-yl)propan-2-yl]acetamide
CID 169203316
N-ethyl-1-(2-methylphenyl)propan-2-amine
CID 14025646
1-[2-(dimethylamino)propyl]indolizin-8-ol
CID 169203335
1-(2-chlorophenyl)-N-ethylpropan-2-amine
CID 43677539
(2S)-N-ethyl-1-[2-(trifluoromethyl)phenyl]propan-2-amine
CID 95029864
1-(2,3-difluorophenyl)-N-propylpropan-2-amine
CID 62601742
1-(3,4-difluorophenyl)-N-ethylpropan-2-amine
CID 24936146
N-ethyl-1-(1-ethyl-4-fluorobenzimidazol-2-yl)propan-2-amine
CID 62826190
2-amino-1-(8-fluoroindolizin-1-yl)propan-1-one
CID 169203280

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(8-fluoroindolizin-1-yl)propan-2-amine?
The IUPAC name of N-ethyl-1-(8-fluoroindolizin-1-yl)propan-2-amine (CID 169203514) is N-ethyl-1-(8-fluoroindolizin-1-yl)propan-2-amine.
What is the SMILES notation for N-ethyl-1-(8-fluoroindolizin-1-yl)propan-2-amine?
The canonical SMILES for N-ethyl-1-(8-fluoroindolizin-1-yl)propan-2-amine is CCNC(C)Cc1ccn2cccc(F)c12.
What is the InChIKey of N-ethyl-1-(8-fluoroindolizin-1-yl)propan-2-amine?
The InChIKey is CTOKDQKOVZPYKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17FN2/c1-3-15-10(2)9-11-6-8-16-7-4-5-12(14)13(11)16/h4-8,10,15H,3,9H2,1-2H3.
What are the key properties of N-ethyl-1-(8-fluoroindolizin-1-yl)propan-2-amine?
N-ethyl-1-(8-fluoroindolizin-1-yl)propan-2-amine has a molecular weight of 220.29 g/mol, XLogP of 2.62, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(8-fluoroindolizin-1-yl)propan-2-amine is sourced from PubChem (CID 169203514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).