5-[4-(difluoromethoxy)phenyl]thiophen-2-amine

C11H9F2NOS — CID 19014321

IUPAC5-[4-(difluoromethoxy)phenyl]thiophen-2-amine
SMILESNc1ccc(-c2ccc(OC(F)F)cc2)s1
InChIInChI=1S/C11H9F2NOS/c12-11(13)15-8-3-1-7(2-4-8)9-5-6-10(14)16-9/h1-6,11H,14H2
InChIKeyGJBBLYSAUSPHGW-UHFFFAOYSA-N
MW241.26 g/mol
LogP3.60
Rot. Bonds3

About 5-[4-(difluoromethoxy)phenyl]thiophen-2-amine

5-[4-(difluoromethoxy)phenyl]thiophen-2-amine (PubChem CID 19014321) has the molecular formula C11H9F2NOS and a molecular weight of 241.26 g/mol. Its IUPAC name is 5-[4-(difluoromethoxy)phenyl]thiophen-2-amine.

Molecular Properties

Compound Name5-[4-(difluoromethoxy)phenyl]thiophen-2-amine
PubChem CID19014321
Molecular FormulaC11H9F2NOS
Molecular Weight241.26 g/mol
Exact Mass241.04
IUPAC Name5-[4-(difluoromethoxy)phenyl]thiophen-2-amine
SMILESNc1ccc(-c2ccc(OC(F)F)cc2)s1
InChIInChI=1S/C11H9F2NOS/c12-11(13)15-8-3-1-7(2-4-8)9-5-6-10(14)16-9/h1-6,11H,14H2
InChIKeyGJBBLYSAUSPHGW-UHFFFAOYSA-N
XLogP3.60
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.26
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(5-(4-Methoxyphenyl)thiophen-2-yl)benzenamine
CID 44408839
5-Methoxybenzo[b]thiophen-2-amine
CID 67305134
2-Amino-4-(4-methoxyphenyl)thiophene-3-carbonitrile
CID 16784318
4-[4-(4-Methylphenoxy)phenyl]thiophen-2-amine;hydroiodide
CID 171356315
Thiophene, 2-(4-methoxyphenyl)-5-nitro-
CID 10998963
5-(4-Methoxyphenyl)thiophen-3-amine
CID 101521625
5-[4-(Trifluoromethoxy)phenyl]thiophen-2-amine
CID 19014313
4-Methyl-5-[4-(trifluoromethoxy)phenyl]thiophen-2-amine
CID 20026745
3-Methoxy-4-[5-(trifluoromethyl)thiophen-2-yl]aniline
CID 20231434
1-[5-[4-(Trifluoromethoxy)phenyl]thiophen-2-yl]pyrrolidine
CID 57202363
2-Isocyano-5-[3-(trifluoromethyl)phenoxy]thiophene
CID 58104551
[5-[4-(Trifluoromethoxy)phenyl]thiophen-2-yl]methanamine
CID 64312224

Frequently Asked Questions

What is the IUPAC name of 5-[4-(difluoromethoxy)phenyl]thiophen-2-amine?
The IUPAC name of 5-[4-(difluoromethoxy)phenyl]thiophen-2-amine (CID 19014321) is 5-[4-(difluoromethoxy)phenyl]thiophen-2-amine.
What is the SMILES notation for 5-[4-(difluoromethoxy)phenyl]thiophen-2-amine?
The canonical SMILES for 5-[4-(difluoromethoxy)phenyl]thiophen-2-amine is Nc1ccc(-c2ccc(OC(F)F)cc2)s1.
What is the InChIKey of 5-[4-(difluoromethoxy)phenyl]thiophen-2-amine?
The InChIKey is GJBBLYSAUSPHGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9F2NOS/c12-11(13)15-8-3-1-7(2-4-8)9-5-6-10(14)16-9/h1-6,11H,14H2.
What are the key properties of 5-[4-(difluoromethoxy)phenyl]thiophen-2-amine?
5-[4-(difluoromethoxy)phenyl]thiophen-2-amine has a molecular weight of 241.26 g/mol, XLogP of 3.60, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-(difluoromethoxy)phenyl]thiophen-2-amine is sourced from PubChem (CID 19014321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).