5-(2-fluorophenyl)-2-[(6-methyl-2-pyridinyl)amino]thiophene-3-carboxamide

C17H14FN3OS — CID 59525717

IUPAC5-(2-fluorophenyl)-2-[(6-methyl-2-pyridinyl)amino]thiophene-3-carboxamide
SMILESCc1cccc(Nc2sc(-c3ccccc3F)cc2C(N)=O)n1
InChIInChI=1S/C17H14FN3OS/c1-10-5-4-8-15(20-10)21-17-12(16(19)22)9-14(23-17)11-6-2-3-7-13(11)18/h2-9H,1H3,(H2,19,22)(H,20,21)
InChIKeyLVLRUUAOYVXFQO-UHFFFAOYSA-N
MW327.38 g/mol
LogP4.10
Rot. Bonds4

About 5-(2-fluorophenyl)-2-[(6-methyl-2-pyridinyl)amino]thiophene-3-carboxamide

5-(2-fluorophenyl)-2-[(6-methyl-2-pyridinyl)amino]thiophene-3-carboxamide (PubChem CID 59525717) has the molecular formula C17H14FN3OS and a molecular weight of 327.38 g/mol. Its IUPAC name is 5-(2-fluorophenyl)-2-[(6-methyl-2-pyridinyl)amino]thiophene-3-carboxamide.

Molecular Properties

Compound Name5-(2-fluorophenyl)-2-[(6-methyl-2-pyridinyl)amino]thiophene-3-carboxamide
PubChem CID59525717
Molecular FormulaC17H14FN3OS
Molecular Weight327.38 g/mol
Exact Mass327.08
IUPAC Name5-(2-fluorophenyl)-2-[(6-methyl-2-pyridinyl)amino]thiophene-3-carboxamide
SMILESCc1cccc(Nc2sc(-c3ccccc3F)cc2C(N)=O)n1
InChIInChI=1S/C17H14FN3OS/c1-10-5-4-8-15(20-10)21-17-12(16(19)22)9-14(23-17)11-6-2-3-7-13(11)18/h2-9H,1H3,(H2,19,22)(H,20,21)
InChIKeyLVLRUUAOYVXFQO-UHFFFAOYSA-N
XLogP4.10
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.38
LogP ≤ 54.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-Sulfanyl-7-(thiophen-2-yl)-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4-ol
CID 5678845
2-(1-benzothiophen-3-yl)-7-methyl-1H-1,8-naphthyridin-4-one
CID 5470948
5-(2-Fluorophenyl)-2-{[6-(morpholin-4-ylmethyl)pyridin-2-yl]-amino}thiophene-3-carboxamide
CID 25123487
5-Phenyl-2-(pyridin-2-ylamino)thiophene-3-carboxamide
CID 25127137
2-[(6-Methyl-2-pyridinyl)amino]-5-phenylthiophene-3-carboxamide
CID 25127138
2-[(4-Methyl-2-pyridinyl)amino]-5-phenylthiophene-3-carboxamide
CID 25127139
2-[(5-Methyl-2-pyridinyl)amino]-5-phenylthiophene-3-carboxamide
CID 25127140
2-[(5-Fluoro-2-pyridinyl)amino]-5-phenylthiophene-3-carboxamide
CID 25127142
2-[(4-Fluoro-2-pyridinyl)amino]-5-phenylthiophene-3-carboxamide
CID 25127144
2-[(5-Cyano-2-pyridinyl)amino]-5-phenylthiophene-3-carboxamide
CID 25127461
5-Phenyl-2-[[6-(trifluoromethyl)pyridin-2-yl]amino]thiophene-3-carboxamide
CID 25127784
2-[(5-Methylsulfonyl-2-pyridinyl)amino]-5-phenylthiophene-3-carboxamide
CID 25127785

Frequently Asked Questions

What is the IUPAC name of 5-(2-fluorophenyl)-2-[(6-methyl-2-pyridinyl)amino]thiophene-3-carboxamide?
The IUPAC name of 5-(2-fluorophenyl)-2-[(6-methyl-2-pyridinyl)amino]thiophene-3-carboxamide (CID 59525717) is 5-(2-fluorophenyl)-2-[(6-methyl-2-pyridinyl)amino]thiophene-3-carboxamide.
What is the SMILES notation for 5-(2-fluorophenyl)-2-[(6-methyl-2-pyridinyl)amino]thiophene-3-carboxamide?
The canonical SMILES for 5-(2-fluorophenyl)-2-[(6-methyl-2-pyridinyl)amino]thiophene-3-carboxamide is Cc1cccc(Nc2sc(-c3ccccc3F)cc2C(N)=O)n1.
What is the InChIKey of 5-(2-fluorophenyl)-2-[(6-methyl-2-pyridinyl)amino]thiophene-3-carboxamide?
The InChIKey is LVLRUUAOYVXFQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14FN3OS/c1-10-5-4-8-15(20-10)21-17-12(16(19)22)9-14(23-17)11-6-2-3-7-13(11)18/h2-9H,1H3,(H2,19,22)(H,20,21).
What are the key properties of 5-(2-fluorophenyl)-2-[(6-methyl-2-pyridinyl)amino]thiophene-3-carboxamide?
5-(2-fluorophenyl)-2-[(6-methyl-2-pyridinyl)amino]thiophene-3-carboxamide has a molecular weight of 327.38 g/mol, XLogP of 4.10, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-fluorophenyl)-2-[(6-methyl-2-pyridinyl)amino]thiophene-3-carboxamide is sourced from PubChem (CID 59525717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).