5-cyano-4-methoxy-N-piperidin-4-ylpyridine-2-carboxamide;ethane

C15H22N4O2 — CID 145096174

IUPAC5-cyano-4-methoxy-N-piperidin-4-ylpyridine-2-carboxamide;ethane
SMILESCC.COc1cc(C(=O)NC2CCNCC2)ncc1C#N
InChIInChI=1S/C13H16N4O2.C2H6/c1-19-12-6-11(16-8-9(12)7-14)13(18)17-10-2-4-15-5-3-10;1-2/h6,8,10,15H,2-5H2,1H3,(H,17,18);1-2H3
InChIKeyRFSMBOLYQLCYAX-UHFFFAOYSA-N
MW290.37 g/mol
LogP1.47
Rot. Bonds3

About 5-cyano-4-methoxy-N-piperidin-4-ylpyridine-2-carboxamide;ethane

5-cyano-4-methoxy-N-piperidin-4-ylpyridine-2-carboxamide;ethane (PubChem CID 145096174) has the molecular formula C15H22N4O2 and a molecular weight of 290.37 g/mol. Its IUPAC name is 5-cyano-4-methoxy-N-piperidin-4-ylpyridine-2-carboxamide;ethane.

Molecular Properties

Compound Name5-cyano-4-methoxy-N-piperidin-4-ylpyridine-2-carboxamide;ethane
PubChem CID145096174
Molecular FormulaC15H22N4O2
Molecular Weight290.37 g/mol
Exact Mass290.17
IUPAC Name5-cyano-4-methoxy-N-piperidin-4-ylpyridine-2-carboxamide;ethane
SMILESCC.COc1cc(C(=O)NC2CCNCC2)ncc1C#N
InChIInChI=1S/C13H16N4O2.C2H6/c1-19-12-6-11(16-8-9(12)7-14)13(18)17-10-2-4-15-5-3-10;1-2/h6,8,10,15H,2-5H2,1H3,(H,17,18);1-2H3
InChIKeyRFSMBOLYQLCYAX-UHFFFAOYSA-N
XLogP1.47
TPSA87.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-cyano-4-fluoro-2-methoxy-N-piperidin-4-ylbenzamide;hydrochloride
CID 90190051
5-chloro-N-[4-(4-cyano-3-methoxyphenoxy)cyclohexyl]pyridine-2-carboxamide
CID 176992974
5-cyano-4-methoxy-N-[1-[2-(4-methyl-1-oxo-3H-2-benzofuran-5-yl)ethyl]piperidin-4-yl]pyridine-2-carboxamide;ethane
CID 145414112
N-[4-(4-cyano-3-methoxy-N-methylanilino)cyclohexyl]-5-propan-2-ylpyridine-2-carboxamide;molecular hydrogen
CID 176986588
N-[4-(4-cyano-3-methoxy-N-methylanilino)cyclohexyl]-5-propan-2-ylpyrazine-2-carboxamide
CID 176985777
3-hydroxy-4-methoxy-N-piperidin-4-ylbenzamide
CID 79725951
5-bromo-N-piperidin-4-ylpyrazine-2-carboxamide
CID 112531060
N-(azepan-4-yl)-3-methoxy-4-nitrobenzamide
CID 105061010
2-methoxy-N-piperidin-4-ylbenzamide
CID 16780894
N-(azepan-4-yl)-2-methoxy-5-methylbenzamide
CID 105058771
6-(1-hydroxy-2-piperazin-1-ylethyl)-4-methoxypyridine-3-carbonitrile
CID 59568649
2-bromo-3,4,5-trimethoxy-N-piperidin-4-ylbenzamide
CID 127217560

Frequently Asked Questions

What is the IUPAC name of 5-cyano-4-methoxy-N-piperidin-4-ylpyridine-2-carboxamide;ethane?
The IUPAC name of 5-cyano-4-methoxy-N-piperidin-4-ylpyridine-2-carboxamide;ethane (CID 145096174) is 5-cyano-4-methoxy-N-piperidin-4-ylpyridine-2-carboxamide;ethane.
What is the SMILES notation for 5-cyano-4-methoxy-N-piperidin-4-ylpyridine-2-carboxamide;ethane?
The canonical SMILES for 5-cyano-4-methoxy-N-piperidin-4-ylpyridine-2-carboxamide;ethane is CC.COc1cc(C(=O)NC2CCNCC2)ncc1C#N.
What is the InChIKey of 5-cyano-4-methoxy-N-piperidin-4-ylpyridine-2-carboxamide;ethane?
The InChIKey is RFSMBOLYQLCYAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O2.C2H6/c1-19-12-6-11(16-8-9(12)7-14)13(18)17-10-2-4-15-5-3-10;1-2/h6,8,10,15H,2-5H2,1H3,(H,17,18);1-2H3.
What are the key properties of 5-cyano-4-methoxy-N-piperidin-4-ylpyridine-2-carboxamide;ethane?
5-cyano-4-methoxy-N-piperidin-4-ylpyridine-2-carboxamide;ethane has a molecular weight of 290.37 g/mol, XLogP of 1.47, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyano-4-methoxy-N-piperidin-4-ylpyridine-2-carboxamide;ethane is sourced from PubChem (CID 145096174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).