4-ethyl-N-(6-pyrazol-1-yl-3-pyridinyl)oxane-4-carboxamide

C16H20N4O2 — CID 146131318

IUPAC4-ethyl-N-(6-pyrazol-1-yl-3-pyridinyl)oxane-4-carboxamide
SMILESCCC1(C(=O)Nc2ccc(-n3cccn3)nc2)CCOCC1
InChIInChI=1S/C16H20N4O2/c1-2-16(6-10-22-11-7-16)15(21)19-13-4-5-14(17-12-13)20-9-3-8-18-20/h3-5,8-9,12H,2,6-7,10-11H2,1H3,(H,19,21)
InChIKeyXCIRTZJOPXLNMM-UHFFFAOYSA-N
MW300.36 g/mol
LogP2.41
Rot. Bonds4

About 4-ethyl-N-(6-pyrazol-1-yl-3-pyridinyl)oxane-4-carboxamide

4-ethyl-N-(6-pyrazol-1-yl-3-pyridinyl)oxane-4-carboxamide (PubChem CID 146131318) has the molecular formula C16H20N4O2 and a molecular weight of 300.36 g/mol. Its IUPAC name is 4-ethyl-N-(6-pyrazol-1-yl-3-pyridinyl)oxane-4-carboxamide.

Molecular Properties

Compound Name4-ethyl-N-(6-pyrazol-1-yl-3-pyridinyl)oxane-4-carboxamide
PubChem CID146131318
Molecular FormulaC16H20N4O2
Molecular Weight300.36 g/mol
Exact Mass300.16
IUPAC Name4-ethyl-N-(6-pyrazol-1-yl-3-pyridinyl)oxane-4-carboxamide
SMILESCCC1(C(=O)Nc2ccc(-n3cccn3)nc2)CCOCC1
InChIInChI=1S/C16H20N4O2/c1-2-16(6-10-22-11-7-16)15(21)19-13-4-5-14(17-12-13)20-9-3-8-18-20/h3-5,8-9,12H,2,6-7,10-11H2,1H3,(H,19,21)
InChIKeyXCIRTZJOPXLNMM-UHFFFAOYSA-N
XLogP2.41
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(6-pyrazol-1-yl-3-pyridinyl)acetamide
CID 47153389
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CID 119842780
3-methyl-N-(6-pyrazol-1-yl-3-pyridinyl)butanamide
CID 25349174
(2R)-2-methylsulfanyl-N-(6-pyrazol-1-yl-3-pyridinyl)propanamide
CID 38951277
1-(aminomethyl)-N-(6-morpholin-4-yl-3-pyridinyl)cyclobutane-1-carboxamide
CID 115447710
N-(6-pyrazol-1-yl-3-pyridinyl)prop-2-enamide
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4-(methoxymethyl)-N-(6-morpholin-4-yl-3-pyridinyl)piperidine-4-carboxamide;dihydrochloride
CID 120640895
N-[6-(2-methylimidazol-1-yl)-3-pyridinyl]-4-phenyloxane-4-carboxamide
CID 90565111
N-(6-bromo-3-pyridinyl)-1-ethylcyclopropane-1-carboxamide
CID 130163122
2-(cyclopropylamino)-N-(6-pyrazol-1-yl-3-pyridinyl)acetamide
CID 60841807
2-methyl-3-(methylamino)-N-(6-pyrazol-1-yl-3-pyridinyl)propanamide;dihydrochloride
CID 119842771
4-amino-N-(6-pyrazol-1-yl-3-pyridinyl)cyclohexane-1-carboxamide
CID 60849056

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-(6-pyrazol-1-yl-3-pyridinyl)oxane-4-carboxamide?
The IUPAC name of 4-ethyl-N-(6-pyrazol-1-yl-3-pyridinyl)oxane-4-carboxamide (CID 146131318) is 4-ethyl-N-(6-pyrazol-1-yl-3-pyridinyl)oxane-4-carboxamide.
What is the SMILES notation for 4-ethyl-N-(6-pyrazol-1-yl-3-pyridinyl)oxane-4-carboxamide?
The canonical SMILES for 4-ethyl-N-(6-pyrazol-1-yl-3-pyridinyl)oxane-4-carboxamide is CCC1(C(=O)Nc2ccc(-n3cccn3)nc2)CCOCC1.
What is the InChIKey of 4-ethyl-N-(6-pyrazol-1-yl-3-pyridinyl)oxane-4-carboxamide?
The InChIKey is XCIRTZJOPXLNMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O2/c1-2-16(6-10-22-11-7-16)15(21)19-13-4-5-14(17-12-13)20-9-3-8-18-20/h3-5,8-9,12H,2,6-7,10-11H2,1H3,(H,19,21).
What are the key properties of 4-ethyl-N-(6-pyrazol-1-yl-3-pyridinyl)oxane-4-carboxamide?
4-ethyl-N-(6-pyrazol-1-yl-3-pyridinyl)oxane-4-carboxamide has a molecular weight of 300.36 g/mol, XLogP of 2.41, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-(6-pyrazol-1-yl-3-pyridinyl)oxane-4-carboxamide is sourced from PubChem (CID 146131318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).