4-[[1-(6-cyclobutylpyrimidin-4-yl)piperidin-4-yl]methoxy]pyridine-2-carboxamide

C20H25N5O2 — CID 166602822

IUPAC4-[[1-(6-cyclobutylpyrimidin-4-yl)piperidin-4-yl]methoxy]pyridine-2-carboxamide
SMILESNC(=O)c1cc(OCC2CCN(c3cc(C4CCC4)ncn3)CC2)ccn1
InChIInChI=1S/C20H25N5O2/c21-20(26)18-10-16(4-7-22-18)27-12-14-5-8-25(9-6-14)19-11-17(23-13-24-19)15-2-1-3-15/h4,7,10-11,13-15H,1-3,5-6,8-9,12H2,(H2,21,26)
InChIKeyFFFPMUPPGBOZBR-UHFFFAOYSA-N
MW367.45 g/mol
LogP2.53
Rot. Bonds6

About 4-[[1-(6-cyclobutylpyrimidin-4-yl)piperidin-4-yl]methoxy]pyridine-2-carboxamide

4-[[1-(6-cyclobutylpyrimidin-4-yl)piperidin-4-yl]methoxy]pyridine-2-carboxamide (PubChem CID 166602822) has the molecular formula C20H25N5O2 and a molecular weight of 367.45 g/mol. Its IUPAC name is 4-[[1-(6-cyclobutylpyrimidin-4-yl)piperidin-4-yl]methoxy]pyridine-2-carboxamide.

Molecular Properties

Compound Name4-[[1-(6-cyclobutylpyrimidin-4-yl)piperidin-4-yl]methoxy]pyridine-2-carboxamide
PubChem CID166602822
Molecular FormulaC20H25N5O2
Molecular Weight367.45 g/mol
Exact Mass367.20
IUPAC Name4-[[1-(6-cyclobutylpyrimidin-4-yl)piperidin-4-yl]methoxy]pyridine-2-carboxamide
SMILESNC(=O)c1cc(OCC2CCN(c3cc(C4CCC4)ncn3)CC2)ccn1
InChIInChI=1S/C20H25N5O2/c21-20(26)18-10-16(4-7-22-18)27-12-14-5-8-25(9-6-14)19-11-17(23-13-24-19)15-2-1-3-15/h4,7,10-11,13-15H,1-3,5-6,8-9,12H2,(H2,21,26)
InChIKeyFFFPMUPPGBOZBR-UHFFFAOYSA-N
XLogP2.53
TPSA94.23 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.45
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-[[1-(6-cyclobutylpyrimidin-4-yl)piperidin-4-yl]methoxy]pyridine-2-carboxamide?
The IUPAC name of 4-[[1-(6-cyclobutylpyrimidin-4-yl)piperidin-4-yl]methoxy]pyridine-2-carboxamide (CID 166602822) is 4-[[1-(6-cyclobutylpyrimidin-4-yl)piperidin-4-yl]methoxy]pyridine-2-carboxamide.
What is the SMILES notation for 4-[[1-(6-cyclobutylpyrimidin-4-yl)piperidin-4-yl]methoxy]pyridine-2-carboxamide?
The canonical SMILES for 4-[[1-(6-cyclobutylpyrimidin-4-yl)piperidin-4-yl]methoxy]pyridine-2-carboxamide is NC(=O)c1cc(OCC2CCN(c3cc(C4CCC4)ncn3)CC2)ccn1.
What is the InChIKey of 4-[[1-(6-cyclobutylpyrimidin-4-yl)piperidin-4-yl]methoxy]pyridine-2-carboxamide?
The InChIKey is FFFPMUPPGBOZBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N5O2/c21-20(26)18-10-16(4-7-22-18)27-12-14-5-8-25(9-6-14)19-11-17(23-13-24-19)15-2-1-3-15/h4,7,10-11,13-15H,1-3,5-6,8-9,12H2,(H2,21,26).
What are the key properties of 4-[[1-(6-cyclobutylpyrimidin-4-yl)piperidin-4-yl]methoxy]pyridine-2-carboxamide?
4-[[1-(6-cyclobutylpyrimidin-4-yl)piperidin-4-yl]methoxy]pyridine-2-carboxamide has a molecular weight of 367.45 g/mol, XLogP of 2.53, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[1-(6-cyclobutylpyrimidin-4-yl)piperidin-4-yl]methoxy]pyridine-2-carboxamide is sourced from PubChem (CID 166602822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).