N-(5-methoxy-2-morpholin-4-ylphenyl)pyridine-3-carboxamide

C17H19N3O3 — CID 6473397

IUPACN-(5-methoxy-2-morpholin-4-ylphenyl)pyridine-3-carboxamide
SMILESCOc1ccc(N2CCOCC2)c(NC(=O)c2cccnc2)c1
InChIInChI=1S/C17H19N3O3/c1-22-14-4-5-16(20-7-9-23-10-8-20)15(11-14)19-17(21)13-3-2-6-18-12-13/h2-6,11-12H,7-10H2,1H3,(H,19,21)
InChIKeyQMZWDELKHYMLMH-UHFFFAOYSA-N
MW313.36 g/mol
LogP2.18
Rot. Bonds4

About N-(5-methoxy-2-morpholin-4-ylphenyl)pyridine-3-carboxamide

N-(5-methoxy-2-morpholin-4-ylphenyl)pyridine-3-carboxamide (PubChem CID 6473397) has the molecular formula C17H19N3O3 and a molecular weight of 313.36 g/mol. Its IUPAC name is N-(5-methoxy-2-morpholin-4-ylphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(5-methoxy-2-morpholin-4-ylphenyl)pyridine-3-carboxamide
PubChem CID6473397
Molecular FormulaC17H19N3O3
Molecular Weight313.36 g/mol
Exact Mass313.14
IUPAC NameN-(5-methoxy-2-morpholin-4-ylphenyl)pyridine-3-carboxamide
SMILESCOc1ccc(N2CCOCC2)c(NC(=O)c2cccnc2)c1
InChIInChI=1S/C17H19N3O3/c1-22-14-4-5-16(20-7-9-23-10-8-20)15(11-14)19-17(21)13-3-2-6-18-12-13/h2-6,11-12H,7-10H2,1H3,(H,19,21)
InChIKeyQMZWDELKHYMLMH-UHFFFAOYSA-N
XLogP2.18
TPSA63.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.36
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}

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Related Compounds

N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]pyridine-3-carboxamide
CID 1081261
4-fluoro-N-(5-methoxy-2-morpholin-4-ylphenyl)benzamide
CID 6473304
N-(5-fluoro-2-morpholin-4-ylphenyl)-3-methoxybenzamide
CID 113092691
N-(5-methoxy-2-morpholin-4-ylphenyl)-3,4-dimethylbenzamide
CID 17027218
N-(2,4-dimorpholin-4-ylphenyl)pyridine-3-carboxamide
CID 24676967
N-(4-morpholin-4-yl-2,1,3-benzoxadiazol-7-yl)pyridine-3-carboxamide
CID 17173598
4-methoxy-N-(5-morpholin-4-yl-2-pyrrolidin-1-ylphenyl)benzamide
CID 110400402
N-(5-methoxy-2-morpholin-4-ylphenyl)-2-phenoxyacetamide
CID 6471849
N-(5-chloro-2-morpholin-4-ylphenyl)-3,5-dimethoxybenzamide
CID 4034494
5-(4-chlorophenyl)-N-(5-methoxy-2-morpholin-4-ylphenyl)furan-2-carboxamide
CID 17354423
3-[4-morpholin-4-yl-3-(pyridine-3-carbonylamino)anilino]quinoxaline-2-carboxamide
CID 11202203
4-methoxy-N-[2-morpholin-4-yl-5-(tetrazol-1-yl)phenyl]benzamide
CID 50776826

Frequently Asked Questions

What is the IUPAC name of N-(5-methoxy-2-morpholin-4-ylphenyl)pyridine-3-carboxamide?
The IUPAC name of N-(5-methoxy-2-morpholin-4-ylphenyl)pyridine-3-carboxamide (CID 6473397) is N-(5-methoxy-2-morpholin-4-ylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for N-(5-methoxy-2-morpholin-4-ylphenyl)pyridine-3-carboxamide?
The canonical SMILES for N-(5-methoxy-2-morpholin-4-ylphenyl)pyridine-3-carboxamide is COc1ccc(N2CCOCC2)c(NC(=O)c2cccnc2)c1.
What is the InChIKey of N-(5-methoxy-2-morpholin-4-ylphenyl)pyridine-3-carboxamide?
The InChIKey is QMZWDELKHYMLMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O3/c1-22-14-4-5-16(20-7-9-23-10-8-20)15(11-14)19-17(21)13-3-2-6-18-12-13/h2-6,11-12H,7-10H2,1H3,(H,19,21).
What are the key properties of N-(5-methoxy-2-morpholin-4-ylphenyl)pyridine-3-carboxamide?
N-(5-methoxy-2-morpholin-4-ylphenyl)pyridine-3-carboxamide has a molecular weight of 313.36 g/mol, XLogP of 2.18, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methoxy-2-morpholin-4-ylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 6473397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).