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

C16H18N4O3S — CID 110272029

IUPACN-methyl-6-[4-(4-methyl-1,3-thiazole-5-carbonyl)morpholin-2-yl]pyridine-3-carboxamide
SMILESCNC(=O)c1ccc(C2CN(C(=O)c3scnc3C)CCO2)nc1
InChIInChI=1S/C16H18N4O3S/c1-10-14(24-9-19-10)16(22)20-5-6-23-13(8-20)12-4-3-11(7-18-12)15(21)17-2/h3-4,7,9,13H,5-6,8H2,1-2H3,(H,17,21)
InChIKeyLTFBNVKROYYAFB-UHFFFAOYSA-N
MW346.41 g/mol
LogP1.42
Rot. Bonds3

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

N-methyl-6-[4-(4-methyl-1,3-thiazole-5-carbonyl)morpholin-2-yl]pyridine-3-carboxamide (PubChem CID 110272029) has the molecular formula C16H18N4O3S and a molecular weight of 346.41 g/mol. Its IUPAC name is N-methyl-6-[4-(4-methyl-1,3-thiazole-5-carbonyl)morpholin-2-yl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-6-[4-(4-methyl-1,3-thiazole-5-carbonyl)morpholin-2-yl]pyridine-3-carboxamide
PubChem CID110272029
Molecular FormulaC16H18N4O3S
Molecular Weight346.41 g/mol
Exact Mass346.11
IUPAC NameN-methyl-6-[4-(4-methyl-1,3-thiazole-5-carbonyl)morpholin-2-yl]pyridine-3-carboxamide
SMILESCNC(=O)c1ccc(C2CN(C(=O)c3scnc3C)CCO2)nc1
InChIInChI=1S/C16H18N4O3S/c1-10-14(24-9-19-10)16(22)20-5-6-23-13(8-20)12-4-3-11(7-18-12)15(21)17-2/h3-4,7,9,13H,5-6,8H2,1-2H3,(H,17,21)
InChIKeyLTFBNVKROYYAFB-UHFFFAOYSA-N
XLogP1.42
TPSA84.42 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.41
LogP ≤ 51.42
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-(4-methyl-1,3-thiazole-5-carbonyl)morpholin-2-yl]pyridine-3-carboxamide?
The IUPAC name of N-methyl-6-[4-(4-methyl-1,3-thiazole-5-carbonyl)morpholin-2-yl]pyridine-3-carboxamide (CID 110272029) is N-methyl-6-[4-(4-methyl-1,3-thiazole-5-carbonyl)morpholin-2-yl]pyridine-3-carboxamide.
What is the SMILES notation for N-methyl-6-[4-(4-methyl-1,3-thiazole-5-carbonyl)morpholin-2-yl]pyridine-3-carboxamide?
The canonical SMILES for N-methyl-6-[4-(4-methyl-1,3-thiazole-5-carbonyl)morpholin-2-yl]pyridine-3-carboxamide is CNC(=O)c1ccc(C2CN(C(=O)c3scnc3C)CCO2)nc1.
What is the InChIKey of N-methyl-6-[4-(4-methyl-1,3-thiazole-5-carbonyl)morpholin-2-yl]pyridine-3-carboxamide?
The InChIKey is LTFBNVKROYYAFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O3S/c1-10-14(24-9-19-10)16(22)20-5-6-23-13(8-20)12-4-3-11(7-18-12)15(21)17-2/h3-4,7,9,13H,5-6,8H2,1-2H3,(H,17,21).
What are the key properties of N-methyl-6-[4-(4-methyl-1,3-thiazole-5-carbonyl)morpholin-2-yl]pyridine-3-carboxamide?
N-methyl-6-[4-(4-methyl-1,3-thiazole-5-carbonyl)morpholin-2-yl]pyridine-3-carboxamide has a molecular weight of 346.41 g/mol, XLogP of 1.42, 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-(4-methyl-1,3-thiazole-5-carbonyl)morpholin-2-yl]pyridine-3-carboxamide is sourced from PubChem (CID 110272029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).