N-(3-amino-2,2-difluoropropyl)thiophene-3-carboxamide

C8H10F2N2OS — CID 114383347

IUPACN-(3-amino-2,2-difluoropropyl)thiophene-3-carboxamide
SMILESNCC(F)(F)CNC(=O)c1ccsc1
InChIInChI=1S/C8H10F2N2OS/c9-8(10,4-11)5-12-7(13)6-1-2-14-3-6/h1-3H,4-5,11H2,(H,12,13)
InChIKeyDPVJXLTYWGRSCO-UHFFFAOYSA-N
MW220.24 g/mol
LogP1.07
Rot. Bonds4

About N-(3-amino-2,2-difluoropropyl)thiophene-3-carboxamide

N-(3-amino-2,2-difluoropropyl)thiophene-3-carboxamide (PubChem CID 114383347) has the molecular formula C8H10F2N2OS and a molecular weight of 220.24 g/mol. Its IUPAC name is N-(3-amino-2,2-difluoropropyl)thiophene-3-carboxamide.

Molecular Properties

Compound NameN-(3-amino-2,2-difluoropropyl)thiophene-3-carboxamide
PubChem CID114383347
Molecular FormulaC8H10F2N2OS
Molecular Weight220.24 g/mol
Exact Mass220.05
IUPAC NameN-(3-amino-2,2-difluoropropyl)thiophene-3-carboxamide
SMILESNCC(F)(F)CNC(=O)c1ccsc1
InChIInChI=1S/C8H10F2N2OS/c9-8(10,4-11)5-12-7(13)6-1-2-14-3-6/h1-3H,4-5,11H2,(H,12,13)
InChIKeyDPVJXLTYWGRSCO-UHFFFAOYSA-N
XLogP1.07
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.24
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-hydroxy-2-methylpropyl)thiophene-3-carboxamide
CID 65110228
N-(3-amino-2,2-difluoropropyl)-4-chlorobenzamide
CID 114383666
N-(3-amino-2,2-difluoropropyl)-3-hydroxybenzamide
CID 114383539
N-[2-(thiophene-3-carbonylamino)ethyl]thiophene-3-carboxamide
CID 101004058
N-(3-chloro-2,2-dimethylpropyl)thiophene-3-carboxamide
CID 115364717
N-[2-ethyl-2-(hydroxymethyl)butyl]thiophene-3-carboxamide
CID 103843618
N-[3-(2,2,2-trifluoroethylcarbamoyl)phenyl]thiophene-3-carboxamide
CID 17444241
N-(3-amino-2,2-difluoropropyl)-3-chlorobenzamide
CID 114383601
3-hydroxy-3-methyl-4-(thiophene-3-carbonylamino)butanoic acid
CID 66000914
N-(2-methyl-2-phenylpropyl)thiophene-3-carboxamide
CID 39700914
N-[[3-(trifluoromethyl)phenyl]methyl]thiophene-3-carboxamide
CID 17436374
N-(3-amino-2,2-difluoropropyl)-3,4,5-trimethoxybenzamide
CID 114383408

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2,2-difluoropropyl)thiophene-3-carboxamide?
The IUPAC name of N-(3-amino-2,2-difluoropropyl)thiophene-3-carboxamide (CID 114383347) is N-(3-amino-2,2-difluoropropyl)thiophene-3-carboxamide.
What is the SMILES notation for N-(3-amino-2,2-difluoropropyl)thiophene-3-carboxamide?
The canonical SMILES for N-(3-amino-2,2-difluoropropyl)thiophene-3-carboxamide is NCC(F)(F)CNC(=O)c1ccsc1.
What is the InChIKey of N-(3-amino-2,2-difluoropropyl)thiophene-3-carboxamide?
The InChIKey is DPVJXLTYWGRSCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F2N2OS/c9-8(10,4-11)5-12-7(13)6-1-2-14-3-6/h1-3H,4-5,11H2,(H,12,13).
What are the key properties of N-(3-amino-2,2-difluoropropyl)thiophene-3-carboxamide?
N-(3-amino-2,2-difluoropropyl)thiophene-3-carboxamide has a molecular weight of 220.24 g/mol, XLogP of 1.07, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-2,2-difluoropropyl)thiophene-3-carboxamide is sourced from PubChem (CID 114383347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).