N-(5-methyl-2-pyridinyl)-6-morpholin-4-ylpyridine-3-carboxamide

C16H18N4O2 — CID 18142509

IUPACN-(5-methyl-2-pyridinyl)-6-morpholin-4-ylpyridine-3-carboxamide
SMILESCc1ccc(NC(=O)c2ccc(N3CCOCC3)nc2)nc1
InChIInChI=1S/C16H18N4O2/c1-12-2-4-14(17-10-12)19-16(21)13-3-5-15(18-11-13)20-6-8-22-9-7-20/h2-5,10-11H,6-9H2,1H3,(H,17,19,21)
InChIKeyODOCXFLYSLMBFW-UHFFFAOYSA-N
MW298.35 g/mol
LogP1.87
Rot. Bonds3

About N-(5-methyl-2-pyridinyl)-6-morpholin-4-ylpyridine-3-carboxamide

N-(5-methyl-2-pyridinyl)-6-morpholin-4-ylpyridine-3-carboxamide (PubChem CID 18142509) has the molecular formula C16H18N4O2 and a molecular weight of 298.35 g/mol. Its IUPAC name is N-(5-methyl-2-pyridinyl)-6-morpholin-4-ylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(5-methyl-2-pyridinyl)-6-morpholin-4-ylpyridine-3-carboxamide
PubChem CID18142509
Molecular FormulaC16H18N4O2
Molecular Weight298.35 g/mol
Exact Mass298.14
IUPAC NameN-(5-methyl-2-pyridinyl)-6-morpholin-4-ylpyridine-3-carboxamide
SMILESCc1ccc(NC(=O)c2ccc(N3CCOCC3)nc2)nc1
InChIInChI=1S/C16H18N4O2/c1-12-2-4-14(17-10-12)19-16(21)13-3-5-15(18-11-13)20-6-8-22-9-7-20/h2-5,10-11H,6-9H2,1H3,(H,17,19,21)
InChIKeyODOCXFLYSLMBFW-UHFFFAOYSA-N
XLogP1.87
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.35
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-2-pyridinyl)-6-morpholin-4-ylpyridine-3-carboxamide?
The IUPAC name of N-(5-methyl-2-pyridinyl)-6-morpholin-4-ylpyridine-3-carboxamide (CID 18142509) is N-(5-methyl-2-pyridinyl)-6-morpholin-4-ylpyridine-3-carboxamide.
What is the SMILES notation for N-(5-methyl-2-pyridinyl)-6-morpholin-4-ylpyridine-3-carboxamide?
The canonical SMILES for N-(5-methyl-2-pyridinyl)-6-morpholin-4-ylpyridine-3-carboxamide is Cc1ccc(NC(=O)c2ccc(N3CCOCC3)nc2)nc1.
What is the InChIKey of N-(5-methyl-2-pyridinyl)-6-morpholin-4-ylpyridine-3-carboxamide?
The InChIKey is ODOCXFLYSLMBFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O2/c1-12-2-4-14(17-10-12)19-16(21)13-3-5-15(18-11-13)20-6-8-22-9-7-20/h2-5,10-11H,6-9H2,1H3,(H,17,19,21).
What are the key properties of N-(5-methyl-2-pyridinyl)-6-morpholin-4-ylpyridine-3-carboxamide?
N-(5-methyl-2-pyridinyl)-6-morpholin-4-ylpyridine-3-carboxamide has a molecular weight of 298.35 g/mol, XLogP of 1.87, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-2-pyridinyl)-6-morpholin-4-ylpyridine-3-carboxamide is sourced from PubChem (CID 18142509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).