N-(2-methylphenyl)-5-morpholin-4-ylpyridine-3-carboxamide

C17H19N3O2 — CID 109228626

IUPACN-(2-methylphenyl)-5-morpholin-4-ylpyridine-3-carboxamide
SMILESCc1ccccc1NC(=O)c1cncc(N2CCOCC2)c1
InChIInChI=1S/C17H19N3O2/c1-13-4-2-3-5-16(13)19-17(21)14-10-15(12-18-11-14)20-6-8-22-9-7-20/h2-5,10-12H,6-9H2,1H3,(H,19,21)
InChIKeyNISZRSKCCLMGFS-UHFFFAOYSA-N
MW297.36 g/mol
LogP2.48
Rot. Bonds3

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

N-(2-methylphenyl)-5-morpholin-4-ylpyridine-3-carboxamide (PubChem CID 109228626) has the molecular formula C17H19N3O2 and a molecular weight of 297.36 g/mol. Its IUPAC name is N-(2-methylphenyl)-5-morpholin-4-ylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-methylphenyl)-5-morpholin-4-ylpyridine-3-carboxamide
PubChem CID109228626
Molecular FormulaC17H19N3O2
Molecular Weight297.36 g/mol
Exact Mass297.15
IUPAC NameN-(2-methylphenyl)-5-morpholin-4-ylpyridine-3-carboxamide
SMILESCc1ccccc1NC(=O)c1cncc(N2CCOCC2)c1
InChIInChI=1S/C17H19N3O2/c1-13-4-2-3-5-16(13)19-17(21)14-10-15(12-18-11-14)20-6-8-22-9-7-20/h2-5,10-12H,6-9H2,1H3,(H,19,21)
InChIKeyNISZRSKCCLMGFS-UHFFFAOYSA-N
XLogP2.48
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.36
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl 2-[(5-morpholin-4-ylpyridine-3-carbonyl)amino]benzoate
CID 109228723
N-(3,4-dimethylphenyl)-5-morpholin-4-ylpyridine-3-carboxamide
CID 109228634
N-[(2-methylphenyl)methyl]-5-morpholin-4-ylpyridine-3-carboxamide
CID 109228561
N-(3-acetylphenyl)-5-morpholin-4-ylpyridine-3-carboxamide
CID 109228678
N-(4-chloro-2-methylphenyl)-5-pyrrolidin-1-ylpyridine-3-carboxamide
CID 109225802
5-morpholin-4-yl-N-propan-2-ylpyridine-3-carboxamide
CID 109223170
N-[2-chloro-5-(trifluoromethyl)phenyl]-5-morpholin-4-ylpyridine-3-carboxamide
CID 109228686
N-(2-chlorophenyl)-5-(4-formylpiperazin-1-yl)pyridine-3-carboxamide
CID 109230953
[4-(2,3-dimethylphenyl)piperazin-1-yl]-(5-morpholin-4-yl-3-pyridinyl)methanone
CID 109228601
N-(2-tert-butylphenyl)-5-(4-formylpiperazin-1-yl)pyridine-3-carboxamide
CID 109230949
5-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N-(2-ethylphenyl)pyridine-3-carboxamide
CID 109238070
3-chloro-4-methyl-N-(2-morpholin-4-ylphenyl)benzamide
CID 898180

Frequently Asked Questions

What is the IUPAC name of N-(2-methylphenyl)-5-morpholin-4-ylpyridine-3-carboxamide?
The IUPAC name of N-(2-methylphenyl)-5-morpholin-4-ylpyridine-3-carboxamide (CID 109228626) is N-(2-methylphenyl)-5-morpholin-4-ylpyridine-3-carboxamide.
What is the SMILES notation for N-(2-methylphenyl)-5-morpholin-4-ylpyridine-3-carboxamide?
The canonical SMILES for N-(2-methylphenyl)-5-morpholin-4-ylpyridine-3-carboxamide is Cc1ccccc1NC(=O)c1cncc(N2CCOCC2)c1.
What is the InChIKey of N-(2-methylphenyl)-5-morpholin-4-ylpyridine-3-carboxamide?
The InChIKey is NISZRSKCCLMGFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O2/c1-13-4-2-3-5-16(13)19-17(21)14-10-15(12-18-11-14)20-6-8-22-9-7-20/h2-5,10-12H,6-9H2,1H3,(H,19,21).
What are the key properties of N-(2-methylphenyl)-5-morpholin-4-ylpyridine-3-carboxamide?
N-(2-methylphenyl)-5-morpholin-4-ylpyridine-3-carboxamide has a molecular weight of 297.36 g/mol, XLogP of 2.48, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylphenyl)-5-morpholin-4-ylpyridine-3-carboxamide is sourced from PubChem (CID 109228626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).