5-morpholin-4-yl-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide

C16H18N4O2 — CID 109184765

IUPAC5-morpholin-4-yl-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide
SMILESO=C(NCc1cccnc1)c1ccc(N2CCOCC2)cn1
InChIInChI=1S/C16H18N4O2/c21-16(19-11-13-2-1-5-17-10-13)15-4-3-14(12-18-15)20-6-8-22-9-7-20/h1-5,10,12H,6-9,11H2,(H,19,21)
InChIKeyCLUKCLBPOPDXQE-UHFFFAOYSA-N
MW298.35 g/mol
LogP1.24
Rot. Bonds4

About 5-morpholin-4-yl-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide

5-morpholin-4-yl-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide (PubChem CID 109184765) has the molecular formula C16H18N4O2 and a molecular weight of 298.35 g/mol. Its IUPAC name is 5-morpholin-4-yl-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-morpholin-4-yl-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide
PubChem CID109184765
Molecular FormulaC16H18N4O2
Molecular Weight298.35 g/mol
Exact Mass298.14
IUPAC Name5-morpholin-4-yl-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide
SMILESO=C(NCc1cccnc1)c1ccc(N2CCOCC2)cn1
InChIInChI=1S/C16H18N4O2/c21-16(19-11-13-2-1-5-17-10-13)15-4-3-14(12-18-15)20-6-8-22-9-7-20/h1-5,10,12H,6-9,11H2,(H,19,21)
InChIKeyCLUKCLBPOPDXQE-UHFFFAOYSA-N
XLogP1.24
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.35
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide
CID 109191186
5-(2-morpholin-4-ylethylamino)-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide
CID 109185798
N-[(4-morpholin-4-ylphenyl)methyl]pyridine-3-carboxamide
CID 94249234
N-benzyl-5-[4-(4-fluorophenyl)piperazin-1-yl]pyridine-2-carboxamide
CID 109187850
2-[4-(4-chlorophenyl)piperazin-1-yl]-N-(pyridin-3-ylmethyl)-1,3-thiazole-4-carboxamide
CID 53200939
N-(pyridin-4-ylmethyl)-5-(4-pyridin-2-ylpiperazin-1-yl)pyridine-2-carboxamide
CID 109191479
N-[(3-chlorophenyl)methyl]-4-morpholin-4-ylpyridine-2-carboxamide
CID 9401810
N-[(5-methyl-3-pyridinyl)methyl]-4-morpholin-4-ylpyridine-2-carboxamide
CID 99634295
2-morpholin-4-ylsulfonyl-N-(pyridin-3-ylmethyl)benzamide
CID 31972800
5-(ethylamino)-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide
CID 104639627
3-morpholin-4-yl-3-oxo-N-(pyridin-3-ylmethyl)propanamide
CID 108943446
5-(6-morpholin-4-yl-3-pyridinyl)-N-(pyridin-3-ylmethyl)thiophene-2-carboxamide
CID 117084261

Frequently Asked Questions

What is the IUPAC name of 5-morpholin-4-yl-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide?
The IUPAC name of 5-morpholin-4-yl-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide (CID 109184765) is 5-morpholin-4-yl-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-morpholin-4-yl-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide?
The canonical SMILES for 5-morpholin-4-yl-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide is O=C(NCc1cccnc1)c1ccc(N2CCOCC2)cn1.
What is the InChIKey of 5-morpholin-4-yl-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide?
The InChIKey is CLUKCLBPOPDXQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O2/c21-16(19-11-13-2-1-5-17-10-13)15-4-3-14(12-18-15)20-6-8-22-9-7-20/h1-5,10,12H,6-9,11H2,(H,19,21).
What are the key properties of 5-morpholin-4-yl-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide?
5-morpholin-4-yl-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide has a molecular weight of 298.35 g/mol, XLogP of 1.24, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-morpholin-4-yl-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide is sourced from PubChem (CID 109184765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).