N-(3-chloro-4-methoxyphenyl)-5-morpholin-4-ylpyridine-2-carboxamide

C17H18ClN3O3 — CID 109184851

IUPACN-(3-chloro-4-methoxyphenyl)-5-morpholin-4-ylpyridine-2-carboxamide
SMILESCOc1ccc(NC(=O)c2ccc(N3CCOCC3)cn2)cc1Cl
InChIInChI=1S/C17H18ClN3O3/c1-23-16-5-2-12(10-14(16)18)20-17(22)15-4-3-13(11-19-15)21-6-8-24-9-7-21/h2-5,10-11H,6-9H2,1H3,(H,20,22)
InChIKeyFDTCYOVFOKJNCC-UHFFFAOYSA-N
MW347.80 g/mol
LogP2.83
Rot. Bonds4

About N-(3-chloro-4-methoxyphenyl)-5-morpholin-4-ylpyridine-2-carboxamide

N-(3-chloro-4-methoxyphenyl)-5-morpholin-4-ylpyridine-2-carboxamide (PubChem CID 109184851) has the molecular formula C17H18ClN3O3 and a molecular weight of 347.80 g/mol. Its IUPAC name is N-(3-chloro-4-methoxyphenyl)-5-morpholin-4-ylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-(3-chloro-4-methoxyphenyl)-5-morpholin-4-ylpyridine-2-carboxamide
PubChem CID109184851
Molecular FormulaC17H18ClN3O3
Molecular Weight347.80 g/mol
Exact Mass347.10
IUPAC NameN-(3-chloro-4-methoxyphenyl)-5-morpholin-4-ylpyridine-2-carboxamide
SMILESCOc1ccc(NC(=O)c2ccc(N3CCOCC3)cn2)cc1Cl
InChIInChI=1S/C17H18ClN3O3/c1-23-16-5-2-12(10-14(16)18)20-17(22)15-4-3-13(11-19-15)21-6-8-24-9-7-21/h2-5,10-11H,6-9H2,1H3,(H,20,22)
InChIKeyFDTCYOVFOKJNCC-UHFFFAOYSA-N
XLogP2.83
TPSA63.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.80
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-chloro-4-methoxyphenyl)-5-(2-morpholin-4-ylethylamino)pyridine-2-carboxamide
CID 109185866
N-(3-chloro-4-methoxyphenyl)-6-(morpholine-4-carbonyl)pyridine-2-carboxamide
CID 109096074
N-(3,4-dimethoxyphenyl)-6-morpholin-4-ylpyridazine-3-carboxamide
CID 109114560
5-morpholin-4-yl-N-(4-phenoxyphenyl)pyridine-2-carboxamide
CID 109184886
methyl 6-[(4-methoxy-3-morpholin-4-ylsulfonylphenyl)carbamoyl]pyridine-3-carboxylate
CID 30747968
N-(3-chloro-4-methoxyphenyl)-4-methoxy-3-morpholin-4-ylsulfonylbenzamide
CID 18892295
2-chloro-N-(3-chloro-4-methoxyphenyl)-5-morpholin-4-ylsulfonylbenzamide
CID 26822987
N-(3-chloro-4-methoxyphenyl)-5-(4-methylpiperidin-1-yl)pyrazine-2-carboxamide
CID 109275297
N-(2,3-dichlorophenyl)-5-morpholin-4-ylpyridine-2-carboxamide
CID 109184910
N-(3-chloro-4-methoxyphenyl)-3-morpholin-4-yl-3-oxopropanamide
CID 108943532
N-(3-chloro-4-methoxyphenyl)-5-(2-methoxyanilino)pyridine-2-carboxamide
CID 109199580
5-(azepan-1-yl)-N-(4-methoxyphenyl)pyridine-2-carboxamide
CID 109196895

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-4-methoxyphenyl)-5-morpholin-4-ylpyridine-2-carboxamide?
The IUPAC name of N-(3-chloro-4-methoxyphenyl)-5-morpholin-4-ylpyridine-2-carboxamide (CID 109184851) is N-(3-chloro-4-methoxyphenyl)-5-morpholin-4-ylpyridine-2-carboxamide.
What is the SMILES notation for N-(3-chloro-4-methoxyphenyl)-5-morpholin-4-ylpyridine-2-carboxamide?
The canonical SMILES for N-(3-chloro-4-methoxyphenyl)-5-morpholin-4-ylpyridine-2-carboxamide is COc1ccc(NC(=O)c2ccc(N3CCOCC3)cn2)cc1Cl.
What is the InChIKey of N-(3-chloro-4-methoxyphenyl)-5-morpholin-4-ylpyridine-2-carboxamide?
The InChIKey is FDTCYOVFOKJNCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18ClN3O3/c1-23-16-5-2-12(10-14(16)18)20-17(22)15-4-3-13(11-19-15)21-6-8-24-9-7-21/h2-5,10-11H,6-9H2,1H3,(H,20,22).
What are the key properties of N-(3-chloro-4-methoxyphenyl)-5-morpholin-4-ylpyridine-2-carboxamide?
N-(3-chloro-4-methoxyphenyl)-5-morpholin-4-ylpyridine-2-carboxamide has a molecular weight of 347.80 g/mol, XLogP of 2.83, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-4-methoxyphenyl)-5-morpholin-4-ylpyridine-2-carboxamide is sourced from PubChem (CID 109184851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).