4-fluoro-5-methoxy-4-thiophen-2-ylpentan-1-amine

C10H16FNOS — CID 103392463

IUPAC4-fluoro-5-methoxy-4-thiophen-2-ylpentan-1-amine
SMILESCOCC(F)(CCCN)c1cccs1
InChIInChI=1S/C10H16FNOS/c1-13-8-10(11,5-3-6-12)9-4-2-7-14-9/h2,4,7H,3,5-6,8,12H2,1H3
InChIKeyWNXIBOQCKVQZEW-UHFFFAOYSA-N
MW217.31 g/mol
LogP2.30
Rot. Bonds6

About 4-fluoro-5-methoxy-4-thiophen-2-ylpentan-1-amine

4-fluoro-5-methoxy-4-thiophen-2-ylpentan-1-amine (PubChem CID 103392463) has the molecular formula C10H16FNOS and a molecular weight of 217.31 g/mol. Its IUPAC name is 4-fluoro-5-methoxy-4-thiophen-2-ylpentan-1-amine.

Molecular Properties

Compound Name4-fluoro-5-methoxy-4-thiophen-2-ylpentan-1-amine
PubChem CID103392463
Molecular FormulaC10H16FNOS
Molecular Weight217.31 g/mol
Exact Mass217.09
IUPAC Name4-fluoro-5-methoxy-4-thiophen-2-ylpentan-1-amine
SMILESCOCC(F)(CCCN)c1cccs1
InChIInChI=1S/C10H16FNOS/c1-13-8-10(11,5-3-6-12)9-4-2-7-14-9/h2,4,7H,3,5-6,8,12H2,1H3
InChIKeyWNXIBOQCKVQZEW-UHFFFAOYSA-N
XLogP2.30
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-fluoro-4-(methoxymethyl)-6-thiophen-2-ylhexan-1-amine
CID 103392474
4-(3-bromo-2,6-difluorophenyl)-4-fluoro-5-methoxypentan-1-amine
CID 106943969
4-fluoro-5-methoxy-4-[4-(trifluoromethyl)-3-pyridinyl]pentan-1-amine
CID 103392506
4-fluoro-5-methoxy-4-(2-methoxy-3,4-dimethylphenyl)pentan-1-amine
CID 103434758
3,3-difluoro-2,2-dimethyl-3-thiophen-2-ylpropan-1-amine
CID 116839610
4-(2-ethylpyrazol-3-yl)-4-fluoro-5-methoxypentan-1-amine
CID 103392371
4-fluoro-5-methoxy-4-(7-methyl-1-benzofuran-2-yl)pentan-1-amine
CID 103392440
4-(3-cyclobutylphenyl)-4-fluoro-5-methoxypentan-1-amine
CID 103392614
4-fluoro-4-(methoxymethyl)-5-(1,3-thiazol-2-yl)pentan-1-amine
CID 103392378
2-methyl-2-thiophen-2-ylpropan-1-amine
CID 51664087
4,8,8,8-tetrafluoro-4-(methoxymethyl)octan-1-amine
CID 103392538
(2S)-3-amino-1,1,1-trifluoro-2-thiophen-2-ylpropan-2-ol
CID 95011095

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-5-methoxy-4-thiophen-2-ylpentan-1-amine?
The IUPAC name of 4-fluoro-5-methoxy-4-thiophen-2-ylpentan-1-amine (CID 103392463) is 4-fluoro-5-methoxy-4-thiophen-2-ylpentan-1-amine.
What is the SMILES notation for 4-fluoro-5-methoxy-4-thiophen-2-ylpentan-1-amine?
The canonical SMILES for 4-fluoro-5-methoxy-4-thiophen-2-ylpentan-1-amine is COCC(F)(CCCN)c1cccs1.
What is the InChIKey of 4-fluoro-5-methoxy-4-thiophen-2-ylpentan-1-amine?
The InChIKey is WNXIBOQCKVQZEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16FNOS/c1-13-8-10(11,5-3-6-12)9-4-2-7-14-9/h2,4,7H,3,5-6,8,12H2,1H3.
What are the key properties of 4-fluoro-5-methoxy-4-thiophen-2-ylpentan-1-amine?
4-fluoro-5-methoxy-4-thiophen-2-ylpentan-1-amine has a molecular weight of 217.31 g/mol, XLogP of 2.30, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-5-methoxy-4-thiophen-2-ylpentan-1-amine is sourced from PubChem (CID 103392463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).