5-cyano-6-ethoxy-2-methyl-4-pyridin-4-yl-4H-pyran-3-carboxamide

C15H15N3O3 — CID 610135

IUPAC5-cyano-6-ethoxy-2-methyl-4-pyridin-4-yl-4H-pyran-3-carboxamide
SMILESCCOC1=C(C#N)C(c2ccncc2)C(C(N)=O)=C(C)O1
InChIInChI=1S/C15H15N3O3/c1-3-20-15-11(8-16)13(10-4-6-18-7-5-10)12(14(17)19)9(2)21-15/h4-7,13H,3H2,1-2H3,(H2,17,19)
InChIKeyYNSLGKKHRHIYEA-UHFFFAOYSA-N
MW285.30 g/mol
LogP1.73
Rot. Bonds4

About 5-cyano-6-ethoxy-2-methyl-4-pyridin-4-yl-4H-pyran-3-carboxamide

5-cyano-6-ethoxy-2-methyl-4-pyridin-4-yl-4H-pyran-3-carboxamide (PubChem CID 610135) has the molecular formula C15H15N3O3 and a molecular weight of 285.30 g/mol. Its IUPAC name is 5-cyano-6-ethoxy-2-methyl-4-pyridin-4-yl-4H-pyran-3-carboxamide.

Molecular Properties

Compound Name5-cyano-6-ethoxy-2-methyl-4-pyridin-4-yl-4H-pyran-3-carboxamide
PubChem CID610135
Molecular FormulaC15H15N3O3
Molecular Weight285.30 g/mol
Exact Mass285.11
IUPAC Name5-cyano-6-ethoxy-2-methyl-4-pyridin-4-yl-4H-pyran-3-carboxamide
SMILESCCOC1=C(C#N)C(c2ccncc2)C(C(N)=O)=C(C)O1
InChIInChI=1S/C15H15N3O3/c1-3-20-15-11(8-16)13(10-4-6-18-7-5-10)12(14(17)19)9(2)21-15/h4-7,13H,3H2,1-2H3,(H2,17,19)
InChIKeyYNSLGKKHRHIYEA-UHFFFAOYSA-N
XLogP1.73
TPSA98.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.30
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Launch Full Analysis

Related Compounds

benzyl (4S)-6-amino-5-cyano-2-methyl-4-pyridin-4-yl-4H-pyran-3-carboxylate
CID 690026
ethyl 2-amino-6-tert-butyl-5-cyano-4-pyridin-4-yl-4H-pyran-3-carboxylate
CID 110193135
methyl 2-amino-5-cyano-6-methoxy-4-pyridin-4-yl-4H-pyran-3-carboxylate
CID 3944363
ethyl 6-amino-5-cyano-2-methyl-4-(4-pyrimidin-4-ylphenyl)-4H-pyran-3-carboxylate
CID 169392401
ethyl 6-amino-5-cyano-2-methyl-4-phenyl-4H-pyran-3-carboxylate;hydrate
CID 51056751
ethyl (4R)-5-cyano-2-methyl-4-phenyl-6-pyrrol-1-yl-4H-pyran-3-carboxylate
CID 7343900
ethyl 6-amino-5-cyano-2-methyl-4-(3-pyrazin-2-yloxyphenyl)-4H-pyran-3-carboxylate
CID 169392609
ethyl 6-amino-5-cyano-4-[4-(4-methoxybenzoyl)oxyphenyl]-2-methyl-4H-pyran-3-carboxylate
CID 169391798
ethyl 6-amino-5-cyano-2-methyl-4-[4-(2-trimethylsilylethynyl)phenyl]-4H-pyran-3-carboxylate
CID 169390432
ethyl 6-amino-5-cyano-2-methyl-4-(4-propylphenyl)-4H-pyran-3-carboxylate
CID 169390599
ethyl (4S)-6-amino-5-cyano-2-methyl-4-(4-methylsulfanylphenyl)-4H-pyran-3-carboxylate
CID 689673
ethyl (4R)-6-amino-5-cyano-2-methyl-4-(4-phenylphenyl)-4H-pyran-3-carboxylate
CID 1035685

Frequently Asked Questions

What is the IUPAC name of 5-cyano-6-ethoxy-2-methyl-4-pyridin-4-yl-4H-pyran-3-carboxamide?
The IUPAC name of 5-cyano-6-ethoxy-2-methyl-4-pyridin-4-yl-4H-pyran-3-carboxamide (CID 610135) is 5-cyano-6-ethoxy-2-methyl-4-pyridin-4-yl-4H-pyran-3-carboxamide.
What is the SMILES notation for 5-cyano-6-ethoxy-2-methyl-4-pyridin-4-yl-4H-pyran-3-carboxamide?
The canonical SMILES for 5-cyano-6-ethoxy-2-methyl-4-pyridin-4-yl-4H-pyran-3-carboxamide is CCOC1=C(C#N)C(c2ccncc2)C(C(N)=O)=C(C)O1.
What is the InChIKey of 5-cyano-6-ethoxy-2-methyl-4-pyridin-4-yl-4H-pyran-3-carboxamide?
The InChIKey is YNSLGKKHRHIYEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O3/c1-3-20-15-11(8-16)13(10-4-6-18-7-5-10)12(14(17)19)9(2)21-15/h4-7,13H,3H2,1-2H3,(H2,17,19).
What are the key properties of 5-cyano-6-ethoxy-2-methyl-4-pyridin-4-yl-4H-pyran-3-carboxamide?
5-cyano-6-ethoxy-2-methyl-4-pyridin-4-yl-4H-pyran-3-carboxamide has a molecular weight of 285.30 g/mol, XLogP of 1.73, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyano-6-ethoxy-2-methyl-4-pyridin-4-yl-4H-pyran-3-carboxamide is sourced from PubChem (CID 610135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).