5-ethyl-N-[6-(3-hydroxyprop-1-ynyl)-2-pyridinyl]furan-2-carboxamide

C15H14N2O3 — CID 79096364

IUPAC5-ethyl-N-[6-(3-hydroxyprop-1-ynyl)-2-pyridinyl]furan-2-carboxamide
SMILESCCc1ccc(C(=O)Nc2cccc(C#CCO)n2)o1
InChIInChI=1S/C15H14N2O3/c1-2-12-8-9-13(20-12)15(19)17-14-7-3-5-11(16-14)6-4-10-18/h3,5,7-9,18H,2,10H2,1H3,(H,16,17,19)
InChIKeySAXZUVUKLZMSES-UHFFFAOYSA-N
MW270.29 g/mol
LogP1.83
Rot. Bonds3

About 5-ethyl-N-[6-(3-hydroxyprop-1-ynyl)-2-pyridinyl]furan-2-carboxamide

5-ethyl-N-[6-(3-hydroxyprop-1-ynyl)-2-pyridinyl]furan-2-carboxamide (PubChem CID 79096364) has the molecular formula C15H14N2O3 and a molecular weight of 270.29 g/mol. Its IUPAC name is 5-ethyl-N-[6-(3-hydroxyprop-1-ynyl)-2-pyridinyl]furan-2-carboxamide.

Molecular Properties

Compound Name5-ethyl-N-[6-(3-hydroxyprop-1-ynyl)-2-pyridinyl]furan-2-carboxamide
PubChem CID79096364
Molecular FormulaC15H14N2O3
Molecular Weight270.29 g/mol
Exact Mass270.10
IUPAC Name5-ethyl-N-[6-(3-hydroxyprop-1-ynyl)-2-pyridinyl]furan-2-carboxamide
SMILESCCc1ccc(C(=O)Nc2cccc(C#CCO)n2)o1
InChIInChI=1S/C15H14N2O3/c1-2-12-8-9-13(20-12)15(19)17-14-7-3-5-11(16-14)6-4-10-18/h3,5,7-9,18H,2,10H2,1H3,(H,16,17,19)
InChIKeySAXZUVUKLZMSES-UHFFFAOYSA-N
XLogP1.83
TPSA75.36 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.29
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

N-[6-(3-hydroxyprop-1-ynyl)-2-pyridinyl]-5-nitrofuran-2-carboxamide
CID 60804555
N-[6-(3-hydroxyprop-1-ynyl)-2-pyridinyl]-3-methyl-1,2-oxazole-5-carboxamide
CID 60805086
5-chloro-N-[6-(4-hydroxybut-1-ynyl)-2-pyridinyl]furan-2-carboxamide
CID 60804070
1-ethyl-3-[6-(3-hydroxyprop-1-ynyl)-2-pyridinyl]urea
CID 60814714
N-[6-(3-hydroxyprop-1-ynyl)-2-pyridinyl]-2,2-dimethylbutanamide
CID 62677687
N-[6-(3-hydroxyprop-1-ynyl)-2-pyridinyl]-4-methylsulfanylbenzamide
CID 79214082
N-[6-(3-hydroxyprop-1-ynyl)-2-pyridinyl]-1-methylpyrrole-2-carboxamide
CID 60803494
N-[6-(3-hydroxyprop-1-ynyl)-2-pyridinyl]-1,5-dimethylpyrrole-2-carboxamide
CID 60802463
3-fluoro-N-[6-(3-hydroxyprop-1-ynyl)-2-pyridinyl]pyridine-4-carboxamide
CID 64951684
5-ethyl-N-[4-(3-hydroxyprop-1-ynyl)-2-methylphenyl]furan-2-carboxamide
CID 79094339
N-[6-(3-hydroxyprop-1-ynyl)-2-pyridinyl]-4-methyl-1,3-thiazole-5-carboxamide
CID 60804378
5-chloro-N-[6-(3-hydroxyprop-1-ynyl)-2-pyridinyl]thiophene-2-carboxamide
CID 62276510

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N-[6-(3-hydroxyprop-1-ynyl)-2-pyridinyl]furan-2-carboxamide?
The IUPAC name of 5-ethyl-N-[6-(3-hydroxyprop-1-ynyl)-2-pyridinyl]furan-2-carboxamide (CID 79096364) is 5-ethyl-N-[6-(3-hydroxyprop-1-ynyl)-2-pyridinyl]furan-2-carboxamide.
What is the SMILES notation for 5-ethyl-N-[6-(3-hydroxyprop-1-ynyl)-2-pyridinyl]furan-2-carboxamide?
The canonical SMILES for 5-ethyl-N-[6-(3-hydroxyprop-1-ynyl)-2-pyridinyl]furan-2-carboxamide is CCc1ccc(C(=O)Nc2cccc(C#CCO)n2)o1.
What is the InChIKey of 5-ethyl-N-[6-(3-hydroxyprop-1-ynyl)-2-pyridinyl]furan-2-carboxamide?
The InChIKey is SAXZUVUKLZMSES-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O3/c1-2-12-8-9-13(20-12)15(19)17-14-7-3-5-11(16-14)6-4-10-18/h3,5,7-9,18H,2,10H2,1H3,(H,16,17,19).
What are the key properties of 5-ethyl-N-[6-(3-hydroxyprop-1-ynyl)-2-pyridinyl]furan-2-carboxamide?
5-ethyl-N-[6-(3-hydroxyprop-1-ynyl)-2-pyridinyl]furan-2-carboxamide has a molecular weight of 270.29 g/mol, XLogP of 1.83, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N-[6-(3-hydroxyprop-1-ynyl)-2-pyridinyl]furan-2-carboxamide is sourced from PubChem (CID 79096364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).