3-amino-6-propyl-N-[5-(trifluoromethyl)-2-pyridinyl]thieno[2,3-b]pyridine-2-carboxamide

C17H15F3N4OS — CID 87047894

IUPAC3-amino-6-propyl-N-[5-(trifluoromethyl)-2-pyridinyl]thieno[2,3-b]pyridine-2-carboxamide
SMILESCCCc1ccc2c(N)c(C(=O)Nc3ccc(C(F)(F)F)cn3)sc2n1
InChIInChI=1S/C17H15F3N4OS/c1-2-3-10-5-6-11-13(21)14(26-16(11)23-10)15(25)24-12-7-4-9(8-22-12)17(18,19)20/h4-8H,2-3,21H2,1H3,(H,22,24,25)
InChIKeyVIEWVEMKLVVGLX-UHFFFAOYSA-N
MW380.40 g/mol
LogP4.50
Rot. Bonds4

About 3-amino-6-propyl-N-[5-(trifluoromethyl)-2-pyridinyl]thieno[2,3-b]pyridine-2-carboxamide

3-amino-6-propyl-N-[5-(trifluoromethyl)-2-pyridinyl]thieno[2,3-b]pyridine-2-carboxamide (PubChem CID 87047894) has the molecular formula C17H15F3N4OS and a molecular weight of 380.40 g/mol. Its IUPAC name is 3-amino-6-propyl-N-[5-(trifluoromethyl)-2-pyridinyl]thieno[2,3-b]pyridine-2-carboxamide.

Molecular Properties

Compound Name3-amino-6-propyl-N-[5-(trifluoromethyl)-2-pyridinyl]thieno[2,3-b]pyridine-2-carboxamide
PubChem CID87047894
Molecular FormulaC17H15F3N4OS
Molecular Weight380.40 g/mol
Exact Mass380.09
IUPAC Name3-amino-6-propyl-N-[5-(trifluoromethyl)-2-pyridinyl]thieno[2,3-b]pyridine-2-carboxamide
SMILESCCCc1ccc2c(N)c(C(=O)Nc3ccc(C(F)(F)F)cn3)sc2n1
InChIInChI=1S/C17H15F3N4OS/c1-2-3-10-5-6-11-13(21)14(26-16(11)23-10)15(25)24-12-7-4-9(8-22-12)17(18,19)20/h4-8H,2-3,21H2,1H3,(H,22,24,25)
InChIKeyVIEWVEMKLVVGLX-UHFFFAOYSA-N
XLogP4.50
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.40
LogP ≤ 54.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-amino-6-(3-methoxyphenyl)-N-[5-(trifluoromethyl)-2-pyridinyl]thieno[2,3-b]pyridine-2-carboxamide
CID 87047876
3-amino-N-(4-ethylphenyl)-6-propylthieno[2,3-b]pyridine-2-carboxamide
CID 23888928
3-amino-N-(3-methylphenyl)-6-propylthieno[2,3-b]pyridine-2-carboxamide
CID 23745667
3-amino-N-(4-cyanophenyl)-6-propylthieno[2,3-b]pyridine-2-carboxamide
CID 23916903
ethyl 2-[2-[(3-amino-6-propylthieno[2,3-b]pyridine-2-carbonyl)amino]-1,3-thiazol-5-yl]acetate
CID 23972899
3-amino-N-ethyl-6-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide
CID 79880499
3-amino-N-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]-6-propylthieno[2,3-b]pyridine-2-carboxamide
CID 23914370
3-amino-N-[4-(4-nitrophenyl)sulfanylphenyl]-6-propylthieno[2,3-b]pyridine-2-carboxamide
CID 23944857
3-[(3-amino-6-butylthieno[2,3-b]pyridine-2-carbonyl)amino]benzoic acid
CID 21233452
ethyl 5-[(3-amino-6-propylthieno[2,3-b]pyridine-2-carbonyl)amino]-4-cyano-3-methylthiophene-2-carboxylate
CID 23914236
3-amino-N,N-dicyclohexyl-6-propylthieno[2,3-b]pyridine-2-carboxamide
CID 23971322
5-amino-N-[5-(trifluoromethyl)-2-pyridinyl]pyridine-2-carboxamide
CID 24896989

Frequently Asked Questions

What is the IUPAC name of 3-amino-6-propyl-N-[5-(trifluoromethyl)-2-pyridinyl]thieno[2,3-b]pyridine-2-carboxamide?
The IUPAC name of 3-amino-6-propyl-N-[5-(trifluoromethyl)-2-pyridinyl]thieno[2,3-b]pyridine-2-carboxamide (CID 87047894) is 3-amino-6-propyl-N-[5-(trifluoromethyl)-2-pyridinyl]thieno[2,3-b]pyridine-2-carboxamide.
What is the SMILES notation for 3-amino-6-propyl-N-[5-(trifluoromethyl)-2-pyridinyl]thieno[2,3-b]pyridine-2-carboxamide?
The canonical SMILES for 3-amino-6-propyl-N-[5-(trifluoromethyl)-2-pyridinyl]thieno[2,3-b]pyridine-2-carboxamide is CCCc1ccc2c(N)c(C(=O)Nc3ccc(C(F)(F)F)cn3)sc2n1.
What is the InChIKey of 3-amino-6-propyl-N-[5-(trifluoromethyl)-2-pyridinyl]thieno[2,3-b]pyridine-2-carboxamide?
The InChIKey is VIEWVEMKLVVGLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15F3N4OS/c1-2-3-10-5-6-11-13(21)14(26-16(11)23-10)15(25)24-12-7-4-9(8-22-12)17(18,19)20/h4-8H,2-3,21H2,1H3,(H,22,24,25).
What are the key properties of 3-amino-6-propyl-N-[5-(trifluoromethyl)-2-pyridinyl]thieno[2,3-b]pyridine-2-carboxamide?
3-amino-6-propyl-N-[5-(trifluoromethyl)-2-pyridinyl]thieno[2,3-b]pyridine-2-carboxamide has a molecular weight of 380.40 g/mol, XLogP of 4.50, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-6-propyl-N-[5-(trifluoromethyl)-2-pyridinyl]thieno[2,3-b]pyridine-2-carboxamide is sourced from PubChem (CID 87047894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).