4-methyl-N-[2-methyl-5-(morpholine-4-carbonyl)phenyl]pyridine-3-carboxamide

C19H21N3O3 — CID 136527988

IUPAC4-methyl-N-[2-methyl-5-(morpholine-4-carbonyl)phenyl]pyridine-3-carboxamide
SMILESCc1ccc(C(=O)N2CCOCC2)cc1NC(=O)c1cnccc1C
InChIInChI=1S/C19H21N3O3/c1-13-5-6-20-12-16(13)18(23)21-17-11-15(4-3-14(17)2)19(24)22-7-9-25-10-8-22/h3-6,11-12H,7-10H2,1-2H3,(H,21,23)
InChIKeyYBMGKFITSUYUHT-UHFFFAOYSA-N
MW339.40 g/mol
LogP2.42
Rot. Bonds3

About 4-methyl-N-[2-methyl-5-(morpholine-4-carbonyl)phenyl]pyridine-3-carboxamide

4-methyl-N-[2-methyl-5-(morpholine-4-carbonyl)phenyl]pyridine-3-carboxamide (PubChem CID 136527988) has the molecular formula C19H21N3O3 and a molecular weight of 339.40 g/mol. Its IUPAC name is 4-methyl-N-[2-methyl-5-(morpholine-4-carbonyl)phenyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name4-methyl-N-[2-methyl-5-(morpholine-4-carbonyl)phenyl]pyridine-3-carboxamide
PubChem CID136527988
Molecular FormulaC19H21N3O3
Molecular Weight339.40 g/mol
Exact Mass339.16
IUPAC Name4-methyl-N-[2-methyl-5-(morpholine-4-carbonyl)phenyl]pyridine-3-carboxamide
SMILESCc1ccc(C(=O)N2CCOCC2)cc1NC(=O)c1cnccc1C
InChIInChI=1S/C19H21N3O3/c1-13-5-6-20-12-16(13)18(23)21-17-11-15(4-3-14(17)2)19(24)22-7-9-25-10-8-22/h3-6,11-12H,7-10H2,1-2H3,(H,21,23)
InChIKeyYBMGKFITSUYUHT-UHFFFAOYSA-N
XLogP2.42
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.40
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-fluoro-9-oxo-N-[2-(pyridin-3-yl)propan-2-yl]-9,10-dihydroacridine-3-carboxamide
CID 16748022
5-((2-Methyl-5-((3-(trifluoromethyl)phenyl)carbamoyl)phenyl)amino)pyridine-3-carboxamide
CID 24875320
9-oxo-N-[2-(pyridin-3-yl)propan-2-yl]-9,10-dihydroacridine-3-carboxamide
CID 16748020
9-oxo-N-[2-(pyridin-4-yl)propan-2-yl]-9,10-dihydroacridine-3-carboxamide
CID 16748637
2-((4-pyridyl)methyl)amino-N-(3-(trifluoromethyl)phenyl)benzamide
CID 6398883
Ethyl 2-(4-morpholinyl)-5-[(3-pyridinylcarbonyl)amino]benzoate
CID 3162289
(4-isopropylpiperazin-1-yl)(3-(morpholinomethyl)-1H-indol-6-yl)methanone
CID 24783527
N-(3-methylphenyl)pyridine-3-carboxamide
CID 532819
1-Piperidinyl(2-(4-pyridinylamino)phenyl)methanone
CID 55754
5-((2-Methyl-5-((3-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)phenyl)carbamoyl)phenyl)amino)nicotinamide (3)
CID 118009697
N-(3-methylphenyl)-2-(pyridin-4-ylmethylamino)benzamide
CID 22245146
2-Benzoylamino-N-pyridin-4-yl-benzamide
CID 730926

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[2-methyl-5-(morpholine-4-carbonyl)phenyl]pyridine-3-carboxamide?
The IUPAC name of 4-methyl-N-[2-methyl-5-(morpholine-4-carbonyl)phenyl]pyridine-3-carboxamide (CID 136527988) is 4-methyl-N-[2-methyl-5-(morpholine-4-carbonyl)phenyl]pyridine-3-carboxamide.
What is the SMILES notation for 4-methyl-N-[2-methyl-5-(morpholine-4-carbonyl)phenyl]pyridine-3-carboxamide?
The canonical SMILES for 4-methyl-N-[2-methyl-5-(morpholine-4-carbonyl)phenyl]pyridine-3-carboxamide is Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)c1cnccc1C.
What is the InChIKey of 4-methyl-N-[2-methyl-5-(morpholine-4-carbonyl)phenyl]pyridine-3-carboxamide?
The InChIKey is YBMGKFITSUYUHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O3/c1-13-5-6-20-12-16(13)18(23)21-17-11-15(4-3-14(17)2)19(24)22-7-9-25-10-8-22/h3-6,11-12H,7-10H2,1-2H3,(H,21,23).
What are the key properties of 4-methyl-N-[2-methyl-5-(morpholine-4-carbonyl)phenyl]pyridine-3-carboxamide?
4-methyl-N-[2-methyl-5-(morpholine-4-carbonyl)phenyl]pyridine-3-carboxamide has a molecular weight of 339.40 g/mol, XLogP of 2.42, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[2-methyl-5-(morpholine-4-carbonyl)phenyl]pyridine-3-carboxamide is sourced from PubChem (CID 136527988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).