N-(2-fluoro-1-thiophen-2-ylethyl)propan-2-amine

C9H14FNS — CID 83817718

IUPACN-(2-fluoro-1-thiophen-2-ylethyl)propan-2-amine
SMILESCC(C)NC(CF)c1cccs1
InChIInChI=1S/C9H14FNS/c1-7(2)11-8(6-10)9-4-3-5-12-9/h3-5,7-8,11H,6H2,1-2H3
InChIKeyASGCBMIWMYFXAO-UHFFFAOYSA-N
MW187.28 g/mol
LogP2.76
Rot. Bonds4

About N-(2-fluoro-1-thiophen-2-ylethyl)propan-2-amine

N-(2-fluoro-1-thiophen-2-ylethyl)propan-2-amine (PubChem CID 83817718) has the molecular formula C9H14FNS and a molecular weight of 187.28 g/mol. Its IUPAC name is N-(2-fluoro-1-thiophen-2-ylethyl)propan-2-amine.

Molecular Properties

Compound NameN-(2-fluoro-1-thiophen-2-ylethyl)propan-2-amine
PubChem CID83817718
Molecular FormulaC9H14FNS
Molecular Weight187.28 g/mol
Exact Mass187.08
IUPAC NameN-(2-fluoro-1-thiophen-2-ylethyl)propan-2-amine
SMILESCC(C)NC(CF)c1cccs1
InChIInChI=1S/C9H14FNS/c1-7(2)11-8(6-10)9-4-3-5-12-9/h3-5,7-8,11H,6H2,1-2H3
InChIKeyASGCBMIWMYFXAO-UHFFFAOYSA-N
XLogP2.76
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.28
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(4-methylphenyl)-1-thiophen-2-ylethyl]propan-2-amine
CID 3062035
N-[2-(3-methoxyphenyl)-1-thiophen-2-ylethyl]propan-2-amine
CID 3062037
2-propan-2-ylthiophene
CID 178128598
N-(1,2-dithiophen-2-ylethyl)-1-thiophen-2-ylpropan-2-amine
CID 43783115
2,6-dimethyl-N-(1-thiophen-2-ylpropyl)heptan-4-amine
CID 63456212
N-(2-fluoroethyl)-1-thiophen-2-ylbutan-1-amine
CID 80695322
N-(1-thiophen-2-ylbut-3-enyl)pent-4-en-2-amine
CID 102574543
N-[cyclopropyl(thiophen-2-yl)methyl]propan-2-amine
CID 60713978
N-methyl-2-propan-2-ylsulfanyl-1-thiophen-2-ylethanamine
CID 65131483
5-methyl-N-(1-thiophen-2-ylbutyl)hexan-2-amine
CID 63456390
3-fluoro-N-[(1R)-1-thiophen-2-ylethyl]propan-1-amine
CID 81408503
N-ethyl-4-methyl-1-thiophen-2-ylpentan-1-amine
CID 43490552

Frequently Asked Questions

What is the IUPAC name of N-(2-fluoro-1-thiophen-2-ylethyl)propan-2-amine?
The IUPAC name of N-(2-fluoro-1-thiophen-2-ylethyl)propan-2-amine (CID 83817718) is N-(2-fluoro-1-thiophen-2-ylethyl)propan-2-amine.
What is the SMILES notation for N-(2-fluoro-1-thiophen-2-ylethyl)propan-2-amine?
The canonical SMILES for N-(2-fluoro-1-thiophen-2-ylethyl)propan-2-amine is CC(C)NC(CF)c1cccs1.
What is the InChIKey of N-(2-fluoro-1-thiophen-2-ylethyl)propan-2-amine?
The InChIKey is ASGCBMIWMYFXAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14FNS/c1-7(2)11-8(6-10)9-4-3-5-12-9/h3-5,7-8,11H,6H2,1-2H3.
What are the key properties of N-(2-fluoro-1-thiophen-2-ylethyl)propan-2-amine?
N-(2-fluoro-1-thiophen-2-ylethyl)propan-2-amine has a molecular weight of 187.28 g/mol, XLogP of 2.76, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoro-1-thiophen-2-ylethyl)propan-2-amine is sourced from PubChem (CID 83817718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).