N-(4-cyano-1-methylpyrazol-3-yl)-5-morpholin-4-ylpyridine-3-carboxamide

C15H16N6O2 — CID 127669894

IUPACN-(4-cyano-1-methylpyrazol-3-yl)-5-morpholin-4-ylpyridine-3-carboxamide
SMILESCn1cc(C#N)c(NC(=O)c2cncc(N3CCOCC3)c2)n1
InChIInChI=1S/C15H16N6O2/c1-20-10-12(7-16)14(19-20)18-15(22)11-6-13(9-17-8-11)21-2-4-23-5-3-21/h6,8-10H,2-5H2,1H3,(H,18,19,22)
InChIKeyAXSJTFGZSQJDAQ-UHFFFAOYSA-N
MW312.33 g/mol
LogP0.78
Rot. Bonds3

About N-(4-cyano-1-methylpyrazol-3-yl)-5-morpholin-4-ylpyridine-3-carboxamide

N-(4-cyano-1-methylpyrazol-3-yl)-5-morpholin-4-ylpyridine-3-carboxamide (PubChem CID 127669894) has the molecular formula C15H16N6O2 and a molecular weight of 312.33 g/mol. Its IUPAC name is N-(4-cyano-1-methylpyrazol-3-yl)-5-morpholin-4-ylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(4-cyano-1-methylpyrazol-3-yl)-5-morpholin-4-ylpyridine-3-carboxamide
PubChem CID127669894
Molecular FormulaC15H16N6O2
Molecular Weight312.33 g/mol
Exact Mass312.13
IUPAC NameN-(4-cyano-1-methylpyrazol-3-yl)-5-morpholin-4-ylpyridine-3-carboxamide
SMILESCn1cc(C#N)c(NC(=O)c2cncc(N3CCOCC3)c2)n1
InChIInChI=1S/C15H16N6O2/c1-20-10-12(7-16)14(19-20)18-15(22)11-6-13(9-17-8-11)21-2-4-23-5-3-21/h6,8-10H,2-5H2,1H3,(H,18,19,22)
InChIKeyAXSJTFGZSQJDAQ-UHFFFAOYSA-N
XLogP0.78
TPSA96.07 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.33
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-(4-cyano-1-methylpyrazol-3-yl)-5-morpholin-4-ylpyridine-3-carboxamide?
The IUPAC name of N-(4-cyano-1-methylpyrazol-3-yl)-5-morpholin-4-ylpyridine-3-carboxamide (CID 127669894) is N-(4-cyano-1-methylpyrazol-3-yl)-5-morpholin-4-ylpyridine-3-carboxamide.
What is the SMILES notation for N-(4-cyano-1-methylpyrazol-3-yl)-5-morpholin-4-ylpyridine-3-carboxamide?
The canonical SMILES for N-(4-cyano-1-methylpyrazol-3-yl)-5-morpholin-4-ylpyridine-3-carboxamide is Cn1cc(C#N)c(NC(=O)c2cncc(N3CCOCC3)c2)n1.
What is the InChIKey of N-(4-cyano-1-methylpyrazol-3-yl)-5-morpholin-4-ylpyridine-3-carboxamide?
The InChIKey is AXSJTFGZSQJDAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N6O2/c1-20-10-12(7-16)14(19-20)18-15(22)11-6-13(9-17-8-11)21-2-4-23-5-3-21/h6,8-10H,2-5H2,1H3,(H,18,19,22).
What are the key properties of N-(4-cyano-1-methylpyrazol-3-yl)-5-morpholin-4-ylpyridine-3-carboxamide?
N-(4-cyano-1-methylpyrazol-3-yl)-5-morpholin-4-ylpyridine-3-carboxamide has a molecular weight of 312.33 g/mol, XLogP of 0.78, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyano-1-methylpyrazol-3-yl)-5-morpholin-4-ylpyridine-3-carboxamide is sourced from PubChem (CID 127669894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).