2-methyl-N-[(4-morpholin-4-ylpyrimidin-2-yl)methyl]propanamide

C13H20N4O2 — CID 72718086

IUPAC2-methyl-N-[(4-morpholin-4-ylpyrimidin-2-yl)methyl]propanamide
SMILESCC(C)C(=O)NCc1nccc(N2CCOCC2)n1
InChIInChI=1S/C13H20N4O2/c1-10(2)13(18)15-9-11-14-4-3-12(16-11)17-5-7-19-8-6-17/h3-4,10H,5-9H2,1-2H3,(H,15,18)
InChIKeyDQVFISRBZNULAN-UHFFFAOYSA-N
MW264.33 g/mol
LogP0.59
Rot. Bonds4

About 2-methyl-N-[(4-morpholin-4-ylpyrimidin-2-yl)methyl]propanamide

2-methyl-N-[(4-morpholin-4-ylpyrimidin-2-yl)methyl]propanamide (PubChem CID 72718086) has the molecular formula C13H20N4O2 and a molecular weight of 264.33 g/mol. Its IUPAC name is 2-methyl-N-[(4-morpholin-4-ylpyrimidin-2-yl)methyl]propanamide.

Molecular Properties

Compound Name2-methyl-N-[(4-morpholin-4-ylpyrimidin-2-yl)methyl]propanamide
PubChem CID72718086
Molecular FormulaC13H20N4O2
Molecular Weight264.33 g/mol
Exact Mass264.16
IUPAC Name2-methyl-N-[(4-morpholin-4-ylpyrimidin-2-yl)methyl]propanamide
SMILESCC(C)C(=O)NCc1nccc(N2CCOCC2)n1
InChIInChI=1S/C13H20N4O2/c1-10(2)13(18)15-9-11-14-4-3-12(16-11)17-5-7-19-8-6-17/h3-4,10H,5-9H2,1-2H3,(H,15,18)
InChIKeyDQVFISRBZNULAN-UHFFFAOYSA-N
XLogP0.59
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 50.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(4-morpholin-4-ylpyrimidin-2-yl)methyl]-2-phenylbutanamide
CID 72718115
N-[(4-morpholin-4-ylpyrimidin-2-yl)methyl]pentanamide
CID 72718087
2-methyl-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]propanamide
CID 32585275
4-fluoro-N-[(4-morpholin-4-ylpyrimidin-2-yl)methyl]benzamide
CID 91966739
6-methoxy-N-[(4-morpholin-4-ylpyrimidin-2-yl)methyl]pyridine-3-carboxamide
CID 122318877
N-[(4-morpholin-4-ylpyrimidin-2-yl)methyl]oxolane-3-carboxamide
CID 122318827
4-methyl-N-[(4-morpholin-4-ylpyrimidin-2-yl)methyl]-1,3-thiazole-5-carboxamide
CID 122318875
N-[(4-morpholin-4-ylpyrimidin-2-yl)methyl]adamantane-1-carboxamide
CID 122318757
1-(2-ethoxyphenyl)-3-[(4-morpholin-4-ylpyrimidin-2-yl)methyl]urea
CID 91966791
N-[(4-morpholin-4-ylpyrimidin-2-yl)methyl]-4-phenoxybenzamide
CID 122318793
N-[(4-morpholin-4-ylpyrimidin-2-yl)methyl]-4-propylthiadiazole-5-carboxamide
CID 122318739
3-methoxy-1-methyl-N-[(4-morpholin-4-ylpyrimidin-2-yl)methyl]pyrazole-4-carboxamide
CID 122318787

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(4-morpholin-4-ylpyrimidin-2-yl)methyl]propanamide?
The IUPAC name of 2-methyl-N-[(4-morpholin-4-ylpyrimidin-2-yl)methyl]propanamide (CID 72718086) is 2-methyl-N-[(4-morpholin-4-ylpyrimidin-2-yl)methyl]propanamide.
What is the SMILES notation for 2-methyl-N-[(4-morpholin-4-ylpyrimidin-2-yl)methyl]propanamide?
The canonical SMILES for 2-methyl-N-[(4-morpholin-4-ylpyrimidin-2-yl)methyl]propanamide is CC(C)C(=O)NCc1nccc(N2CCOCC2)n1.
What is the InChIKey of 2-methyl-N-[(4-morpholin-4-ylpyrimidin-2-yl)methyl]propanamide?
The InChIKey is DQVFISRBZNULAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O2/c1-10(2)13(18)15-9-11-14-4-3-12(16-11)17-5-7-19-8-6-17/h3-4,10H,5-9H2,1-2H3,(H,15,18).
What are the key properties of 2-methyl-N-[(4-morpholin-4-ylpyrimidin-2-yl)methyl]propanamide?
2-methyl-N-[(4-morpholin-4-ylpyrimidin-2-yl)methyl]propanamide has a molecular weight of 264.33 g/mol, XLogP of 0.59, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(4-morpholin-4-ylpyrimidin-2-yl)methyl]propanamide is sourced from PubChem (CID 72718086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).