N-(4-methyl-2-pyridinyl)-4-oxo-4-[2-(pyrimidin-2-yloxymethyl)morpholin-4-yl]butanamide

C19H23N5O4 — CID 74225435

IUPACN-(4-methyl-2-pyridinyl)-4-oxo-4-[2-(pyrimidin-2-yloxymethyl)morpholin-4-yl]butanamide
SMILESCc1ccnc(NC(=O)CCC(=O)N2CCOC(COc3ncccn3)C2)c1
InChIInChI=1S/C19H23N5O4/c1-14-5-8-20-16(11-14)23-17(25)3-4-18(26)24-9-10-27-15(12-24)13-28-19-21-6-2-7-22-19/h2,5-8,11,15H,3-4,9-10,12-13H2,1H3,(H,20,23,25)
InChIKeyXQXZWJXZEJBAMB-UHFFFAOYSA-N
MW385.42 g/mol
LogP1.21
Rot. Bonds7

About N-(4-methyl-2-pyridinyl)-4-oxo-4-[2-(pyrimidin-2-yloxymethyl)morpholin-4-yl]butanamide

N-(4-methyl-2-pyridinyl)-4-oxo-4-[2-(pyrimidin-2-yloxymethyl)morpholin-4-yl]butanamide (PubChem CID 74225435) has the molecular formula C19H23N5O4 and a molecular weight of 385.42 g/mol. Its IUPAC name is N-(4-methyl-2-pyridinyl)-4-oxo-4-[2-(pyrimidin-2-yloxymethyl)morpholin-4-yl]butanamide.

Molecular Properties

Compound NameN-(4-methyl-2-pyridinyl)-4-oxo-4-[2-(pyrimidin-2-yloxymethyl)morpholin-4-yl]butanamide
PubChem CID74225435
Molecular FormulaC19H23N5O4
Molecular Weight385.42 g/mol
Exact Mass385.18
IUPAC NameN-(4-methyl-2-pyridinyl)-4-oxo-4-[2-(pyrimidin-2-yloxymethyl)morpholin-4-yl]butanamide
SMILESCc1ccnc(NC(=O)CCC(=O)N2CCOC(COc3ncccn3)C2)c1
InChIInChI=1S/C19H23N5O4/c1-14-5-8-20-16(11-14)23-17(25)3-4-18(26)24-9-10-27-15(12-24)13-28-19-21-6-2-7-22-19/h2,5-8,11,15H,3-4,9-10,12-13H2,1H3,(H,20,23,25)
InChIKeyXQXZWJXZEJBAMB-UHFFFAOYSA-N
XLogP1.21
TPSA106.54 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.42
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-(4-methyl-2-pyridinyl)-4-oxo-4-[2-(pyrimidin-2-yloxymethyl)morpholin-4-yl]butanamide with MolForge

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Related Compounds

3-[3-oxo-3-[2-(pyrimidin-2-yloxymethyl)morpholin-4-yl]propyl]-1,3-benzoxazol-2-one
CID 74225543
N-cyclohexyl-2-(pyrimidin-2-yloxymethyl)morpholine-4-carboxamide
CID 3838021
2-(5-bromo-3-pyridinyl)-1-[2-(pyrimidin-2-yloxymethyl)morpholin-4-yl]ethanone
CID 74228366
2-(pyrimidin-2-yloxymethyl)-N-(2-thiophen-2-ylethyl)morpholine-4-carboxamide
CID 5009855
2-[(3-methylphenoxy)methyl]-N-phenylmorpholine-4-carboxamide
CID 46059378
2-(4-methylphenoxy)-1-[(2S)-2-[(4-methylphenoxy)methyl]morpholin-4-yl]ethanone
CID 92757449
1-[2-(hydroxymethyl)morpholin-4-yl]-3-(3-methylphenoxy)propan-1-one
CID 81208849
1-[2-[(3-methoxyphenoxy)methyl]morpholin-4-yl]propan-1-one
CID 46059317
2-(aminomethyl)-N-(3-methylphenyl)morpholine-4-carboxamide
CID 61337014
N-(4-methyl-2-pyridinyl)-2-morpholin-2-ylacetamide
CID 66434156
(2R)-2-[2-(dimethylamino)pyrimidin-4-yl]-N-(4-methyl-2-pyridinyl)morpholine-4-carboxamide
CID 129477542
2-[(2-chloro-3-pyridinyl)oxymethyl]-N-(4,6-dimethyl-2-pyridinyl)morpholine-4-carboxamide;2,2,2-trifluoroacetic acid
CID 87680787

Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-2-pyridinyl)-4-oxo-4-[2-(pyrimidin-2-yloxymethyl)morpholin-4-yl]butanamide?
The IUPAC name of N-(4-methyl-2-pyridinyl)-4-oxo-4-[2-(pyrimidin-2-yloxymethyl)morpholin-4-yl]butanamide (CID 74225435) is N-(4-methyl-2-pyridinyl)-4-oxo-4-[2-(pyrimidin-2-yloxymethyl)morpholin-4-yl]butanamide.
What is the SMILES notation for N-(4-methyl-2-pyridinyl)-4-oxo-4-[2-(pyrimidin-2-yloxymethyl)morpholin-4-yl]butanamide?
The canonical SMILES for N-(4-methyl-2-pyridinyl)-4-oxo-4-[2-(pyrimidin-2-yloxymethyl)morpholin-4-yl]butanamide is Cc1ccnc(NC(=O)CCC(=O)N2CCOC(COc3ncccn3)C2)c1.
What is the InChIKey of N-(4-methyl-2-pyridinyl)-4-oxo-4-[2-(pyrimidin-2-yloxymethyl)morpholin-4-yl]butanamide?
The InChIKey is XQXZWJXZEJBAMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N5O4/c1-14-5-8-20-16(11-14)23-17(25)3-4-18(26)24-9-10-27-15(12-24)13-28-19-21-6-2-7-22-19/h2,5-8,11,15H,3-4,9-10,12-13H2,1H3,(H,20,23,25).
What are the key properties of N-(4-methyl-2-pyridinyl)-4-oxo-4-[2-(pyrimidin-2-yloxymethyl)morpholin-4-yl]butanamide?
N-(4-methyl-2-pyridinyl)-4-oxo-4-[2-(pyrimidin-2-yloxymethyl)morpholin-4-yl]butanamide has a molecular weight of 385.42 g/mol, XLogP of 1.21, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-2-pyridinyl)-4-oxo-4-[2-(pyrimidin-2-yloxymethyl)morpholin-4-yl]butanamide is sourced from PubChem (CID 74225435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).