N-methyl-6-[4-(5-methyl-1H-pyrazole-4-carbonyl)morpholin-2-yl]pyridine-3-carboxamide

C16H19N5O3 — CID 110271996

IUPACN-methyl-6-[4-(5-methyl-1H-pyrazole-4-carbonyl)morpholin-2-yl]pyridine-3-carboxamide
SMILESCNC(=O)c1ccc(C2CN(C(=O)c3cn[nH]c3C)CCO2)nc1
InChIInChI=1S/C16H19N5O3/c1-10-12(8-19-20-10)16(23)21-5-6-24-14(9-21)13-4-3-11(7-18-13)15(22)17-2/h3-4,7-8,14H,5-6,9H2,1-2H3,(H,17,22)(H,19,20)
InChIKeyAIBHPUCHOQZEJG-UHFFFAOYSA-N
MW329.36 g/mol
LogP0.69
Rot. Bonds3

About N-methyl-6-[4-(5-methyl-1H-pyrazole-4-carbonyl)morpholin-2-yl]pyridine-3-carboxamide

N-methyl-6-[4-(5-methyl-1H-pyrazole-4-carbonyl)morpholin-2-yl]pyridine-3-carboxamide (PubChem CID 110271996) has the molecular formula C16H19N5O3 and a molecular weight of 329.36 g/mol. Its IUPAC name is N-methyl-6-[4-(5-methyl-1H-pyrazole-4-carbonyl)morpholin-2-yl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-6-[4-(5-methyl-1H-pyrazole-4-carbonyl)morpholin-2-yl]pyridine-3-carboxamide
PubChem CID110271996
Molecular FormulaC16H19N5O3
Molecular Weight329.36 g/mol
Exact Mass329.15
IUPAC NameN-methyl-6-[4-(5-methyl-1H-pyrazole-4-carbonyl)morpholin-2-yl]pyridine-3-carboxamide
SMILESCNC(=O)c1ccc(C2CN(C(=O)c3cn[nH]c3C)CCO2)nc1
InChIInChI=1S/C16H19N5O3/c1-10-12(8-19-20-10)16(23)21-5-6-24-14(9-21)13-4-3-11(7-18-13)15(22)17-2/h3-4,7-8,14H,5-6,9H2,1-2H3,(H,17,22)(H,19,20)
InChIKeyAIBHPUCHOQZEJG-UHFFFAOYSA-N
XLogP0.69
TPSA100.21 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.36
LogP ≤ 50.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-6-[4-(5-methyl-1H-pyrazole-4-carbonyl)morpholin-2-yl]pyridine-3-carboxamide?
The IUPAC name of N-methyl-6-[4-(5-methyl-1H-pyrazole-4-carbonyl)morpholin-2-yl]pyridine-3-carboxamide (CID 110271996) is N-methyl-6-[4-(5-methyl-1H-pyrazole-4-carbonyl)morpholin-2-yl]pyridine-3-carboxamide.
What is the SMILES notation for N-methyl-6-[4-(5-methyl-1H-pyrazole-4-carbonyl)morpholin-2-yl]pyridine-3-carboxamide?
The canonical SMILES for N-methyl-6-[4-(5-methyl-1H-pyrazole-4-carbonyl)morpholin-2-yl]pyridine-3-carboxamide is CNC(=O)c1ccc(C2CN(C(=O)c3cn[nH]c3C)CCO2)nc1.
What is the InChIKey of N-methyl-6-[4-(5-methyl-1H-pyrazole-4-carbonyl)morpholin-2-yl]pyridine-3-carboxamide?
The InChIKey is AIBHPUCHOQZEJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N5O3/c1-10-12(8-19-20-10)16(23)21-5-6-24-14(9-21)13-4-3-11(7-18-13)15(22)17-2/h3-4,7-8,14H,5-6,9H2,1-2H3,(H,17,22)(H,19,20).
What are the key properties of N-methyl-6-[4-(5-methyl-1H-pyrazole-4-carbonyl)morpholin-2-yl]pyridine-3-carboxamide?
N-methyl-6-[4-(5-methyl-1H-pyrazole-4-carbonyl)morpholin-2-yl]pyridine-3-carboxamide has a molecular weight of 329.36 g/mol, XLogP of 0.69, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-[4-(5-methyl-1H-pyrazole-4-carbonyl)morpholin-2-yl]pyridine-3-carboxamide is sourced from PubChem (CID 110271996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).