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

C16H19N5O3 — CID 110272004

IUPACN-methyl-6-[4-(1-methylpyrazole-4-carbonyl)morpholin-2-yl]pyridine-3-carboxamide
SMILESCNC(=O)c1ccc(C2CN(C(=O)c3cnn(C)c3)CCO2)nc1
InChIInChI=1S/C16H19N5O3/c1-17-15(22)11-3-4-13(18-7-11)14-10-21(5-6-24-14)16(23)12-8-19-20(2)9-12/h3-4,7-9,14H,5-6,10H2,1-2H3,(H,17,22)
InChIKeyIOXLAPWPAGCQSZ-UHFFFAOYSA-N
MW329.36 g/mol
LogP0.39
Rot. Bonds3

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

N-methyl-6-[4-(1-methylpyrazole-4-carbonyl)morpholin-2-yl]pyridine-3-carboxamide (PubChem CID 110272004) has the molecular formula C16H19N5O3 and a molecular weight of 329.36 g/mol. Its IUPAC name is N-methyl-6-[4-(1-methylpyrazole-4-carbonyl)morpholin-2-yl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-6-[4-(1-methylpyrazole-4-carbonyl)morpholin-2-yl]pyridine-3-carboxamide
PubChem CID110272004
Molecular FormulaC16H19N5O3
Molecular Weight329.36 g/mol
Exact Mass329.15
IUPAC NameN-methyl-6-[4-(1-methylpyrazole-4-carbonyl)morpholin-2-yl]pyridine-3-carboxamide
SMILESCNC(=O)c1ccc(C2CN(C(=O)c3cnn(C)c3)CCO2)nc1
InChIInChI=1S/C16H19N5O3/c1-17-15(22)11-3-4-13(18-7-11)14-10-21(5-6-24-14)16(23)12-8-19-20(2)9-12/h3-4,7-9,14H,5-6,10H2,1-2H3,(H,17,22)
InChIKeyIOXLAPWPAGCQSZ-UHFFFAOYSA-N
XLogP0.39
TPSA89.35 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.36
LogP ≤ 50.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-methyl-6-[4-(1-methylpyrazole-4-carbonyl)morpholin-2-yl]pyridine-3-carboxamide?
The IUPAC name of N-methyl-6-[4-(1-methylpyrazole-4-carbonyl)morpholin-2-yl]pyridine-3-carboxamide (CID 110272004) is N-methyl-6-[4-(1-methylpyrazole-4-carbonyl)morpholin-2-yl]pyridine-3-carboxamide.
What is the SMILES notation for N-methyl-6-[4-(1-methylpyrazole-4-carbonyl)morpholin-2-yl]pyridine-3-carboxamide?
The canonical SMILES for N-methyl-6-[4-(1-methylpyrazole-4-carbonyl)morpholin-2-yl]pyridine-3-carboxamide is CNC(=O)c1ccc(C2CN(C(=O)c3cnn(C)c3)CCO2)nc1.
What is the InChIKey of N-methyl-6-[4-(1-methylpyrazole-4-carbonyl)morpholin-2-yl]pyridine-3-carboxamide?
The InChIKey is IOXLAPWPAGCQSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N5O3/c1-17-15(22)11-3-4-13(18-7-11)14-10-21(5-6-24-14)16(23)12-8-19-20(2)9-12/h3-4,7-9,14H,5-6,10H2,1-2H3,(H,17,22).
What are the key properties of N-methyl-6-[4-(1-methylpyrazole-4-carbonyl)morpholin-2-yl]pyridine-3-carboxamide?
N-methyl-6-[4-(1-methylpyrazole-4-carbonyl)morpholin-2-yl]pyridine-3-carboxamide has a molecular weight of 329.36 g/mol, XLogP of 0.39, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-[4-(1-methylpyrazole-4-carbonyl)morpholin-2-yl]pyridine-3-carboxamide is sourced from PubChem (CID 110272004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).