N-(2,4-dimorpholin-4-ylphenyl)-6-methylpyridine-3-carboxamide

C21H26N4O3 — CID 18149073

IUPACN-(2,4-dimorpholin-4-ylphenyl)-6-methylpyridine-3-carboxamide
SMILESCc1ccc(C(=O)Nc2ccc(N3CCOCC3)cc2N2CCOCC2)cn1
InChIInChI=1S/C21H26N4O3/c1-16-2-3-17(15-22-16)21(26)23-19-5-4-18(24-6-10-27-11-7-24)14-20(19)25-8-12-28-13-9-25/h2-5,14-15H,6-13H2,1H3,(H,23,26)
InChIKeyVHYQMTMMZKEHPZ-UHFFFAOYSA-N
MW382.46 g/mol
LogP2.32
Rot. Bonds4

About N-(2,4-dimorpholin-4-ylphenyl)-6-methylpyridine-3-carboxamide

N-(2,4-dimorpholin-4-ylphenyl)-6-methylpyridine-3-carboxamide (PubChem CID 18149073) has the molecular formula C21H26N4O3 and a molecular weight of 382.46 g/mol. Its IUPAC name is N-(2,4-dimorpholin-4-ylphenyl)-6-methylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2,4-dimorpholin-4-ylphenyl)-6-methylpyridine-3-carboxamide
PubChem CID18149073
Molecular FormulaC21H26N4O3
Molecular Weight382.46 g/mol
Exact Mass382.20
IUPAC NameN-(2,4-dimorpholin-4-ylphenyl)-6-methylpyridine-3-carboxamide
SMILESCc1ccc(C(=O)Nc2ccc(N3CCOCC3)cc2N2CCOCC2)cn1
InChIInChI=1S/C21H26N4O3/c1-16-2-3-17(15-22-16)21(26)23-19-5-4-18(24-6-10-27-11-7-24)14-20(19)25-8-12-28-13-9-25/h2-5,14-15H,6-13H2,1H3,(H,23,26)
InChIKeyVHYQMTMMZKEHPZ-UHFFFAOYSA-N
XLogP2.32
TPSA66.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.46
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

6-methyl-N-(2-morpholin-4-ylphenyl)pyridine-3-carboxamide
CID 18148178
N-(2,4-dimorpholin-4-ylphenyl)pyridine-3-carboxamide
CID 24676967
1-tert-butyl-N-(2,4-dimorpholin-4-ylphenyl)pyrazole-4-carboxamide
CID 112839574
N-(2,4-dimorpholin-4-ylphenyl)-3-propan-2-yl-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide
CID 25333039
N-(2,4-dimorpholin-4-ylphenyl)-3-fluorobenzamide
CID 4824008
3-(dimethylamino)-N-(2,4-dimorpholin-4-ylphenyl)benzamide
CID 26072175
N-[5-[(2,4-dimorpholin-4-ylphenyl)carbamoyl]-2-methylphenyl]furan-2-carboxamide
CID 24653710
N-(2,4-dimorpholin-4-ylphenyl)-3-methyl-1H-pyrrole-2-carboxamide
CID 167806321
N-(2,4-dimorpholin-4-ylphenyl)-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide
CID 4794943
N-(2,4-dimorpholin-4-ylphenyl)-2-methylcyclopropane-1-carboxamide
CID 112761839
4-chloro-N-(2,4-dimorpholin-4-ylphenyl)-3-nitrobenzamide
CID 4824096
N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-6-morpholin-4-ylpyridine-3-carboxamide
CID 38760833

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimorpholin-4-ylphenyl)-6-methylpyridine-3-carboxamide?
The IUPAC name of N-(2,4-dimorpholin-4-ylphenyl)-6-methylpyridine-3-carboxamide (CID 18149073) is N-(2,4-dimorpholin-4-ylphenyl)-6-methylpyridine-3-carboxamide.
What is the SMILES notation for N-(2,4-dimorpholin-4-ylphenyl)-6-methylpyridine-3-carboxamide?
The canonical SMILES for N-(2,4-dimorpholin-4-ylphenyl)-6-methylpyridine-3-carboxamide is Cc1ccc(C(=O)Nc2ccc(N3CCOCC3)cc2N2CCOCC2)cn1.
What is the InChIKey of N-(2,4-dimorpholin-4-ylphenyl)-6-methylpyridine-3-carboxamide?
The InChIKey is VHYQMTMMZKEHPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N4O3/c1-16-2-3-17(15-22-16)21(26)23-19-5-4-18(24-6-10-27-11-7-24)14-20(19)25-8-12-28-13-9-25/h2-5,14-15H,6-13H2,1H3,(H,23,26).
What are the key properties of N-(2,4-dimorpholin-4-ylphenyl)-6-methylpyridine-3-carboxamide?
N-(2,4-dimorpholin-4-ylphenyl)-6-methylpyridine-3-carboxamide has a molecular weight of 382.46 g/mol, XLogP of 2.32, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimorpholin-4-ylphenyl)-6-methylpyridine-3-carboxamide is sourced from PubChem (CID 18149073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).