2-fluoro-2-methyl-N-(1-thiophen-3-ylethyl)propanamide

C10H14FNOS — CID 130507532

IUPAC2-fluoro-2-methyl-N-(1-thiophen-3-ylethyl)propanamide
SMILESCC(NC(=O)C(C)(C)F)c1ccsc1
InChIInChI=1S/C10H14FNOS/c1-7(8-4-5-14-6-8)12-9(13)10(2,3)11/h4-7H,1-3H3,(H,12,13)
InChIKeyVRTBUWGYQPVDNS-UHFFFAOYSA-N
MW215.29 g/mol
LogP2.67
Rot. Bonds3

About 2-fluoro-2-methyl-N-(1-thiophen-3-ylethyl)propanamide

2-fluoro-2-methyl-N-(1-thiophen-3-ylethyl)propanamide (PubChem CID 130507532) has the molecular formula C10H14FNOS and a molecular weight of 215.29 g/mol. Its IUPAC name is 2-fluoro-2-methyl-N-(1-thiophen-3-ylethyl)propanamide.

Molecular Properties

Compound Name2-fluoro-2-methyl-N-(1-thiophen-3-ylethyl)propanamide
PubChem CID130507532
Molecular FormulaC10H14FNOS
Molecular Weight215.29 g/mol
Exact Mass215.08
IUPAC Name2-fluoro-2-methyl-N-(1-thiophen-3-ylethyl)propanamide
SMILESCC(NC(=O)C(C)(C)F)c1ccsc1
InChIInChI=1S/C10H14FNOS/c1-7(8-4-5-14-6-8)12-9(13)10(2,3)11/h4-7H,1-3H3,(H,12,13)
InChIKeyVRTBUWGYQPVDNS-UHFFFAOYSA-N
XLogP2.67
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.29
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-2-methyl-N-(1-thiophen-3-ylethyl)propanamide?
The IUPAC name of 2-fluoro-2-methyl-N-(1-thiophen-3-ylethyl)propanamide (CID 130507532) is 2-fluoro-2-methyl-N-(1-thiophen-3-ylethyl)propanamide.
What is the SMILES notation for 2-fluoro-2-methyl-N-(1-thiophen-3-ylethyl)propanamide?
The canonical SMILES for 2-fluoro-2-methyl-N-(1-thiophen-3-ylethyl)propanamide is CC(NC(=O)C(C)(C)F)c1ccsc1.
What is the InChIKey of 2-fluoro-2-methyl-N-(1-thiophen-3-ylethyl)propanamide?
The InChIKey is VRTBUWGYQPVDNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14FNOS/c1-7(8-4-5-14-6-8)12-9(13)10(2,3)11/h4-7H,1-3H3,(H,12,13).
What are the key properties of 2-fluoro-2-methyl-N-(1-thiophen-3-ylethyl)propanamide?
2-fluoro-2-methyl-N-(1-thiophen-3-ylethyl)propanamide has a molecular weight of 215.29 g/mol, XLogP of 2.67, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-2-methyl-N-(1-thiophen-3-ylethyl)propanamide is sourced from PubChem (CID 130507532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).