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

C15H24N4O2 — CID 122353332

IUPAC2-ethyl-N-[(2-morpholin-4-ylpyrimidin-4-yl)methyl]butanamide
SMILESCCC(CC)C(=O)NCc1ccnc(N2CCOCC2)n1
InChIInChI=1S/C15H24N4O2/c1-3-12(4-2)14(20)17-11-13-5-6-16-15(18-13)19-7-9-21-10-8-19/h5-6,12H,3-4,7-11H2,1-2H3,(H,17,20)
InChIKeyVWEUWKRENBHKPI-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.37
Rot. Bonds6

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

2-ethyl-N-[(2-morpholin-4-ylpyrimidin-4-yl)methyl]butanamide (PubChem CID 122353332) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is 2-ethyl-N-[(2-morpholin-4-ylpyrimidin-4-yl)methyl]butanamide.

Molecular Properties

Compound Name2-ethyl-N-[(2-morpholin-4-ylpyrimidin-4-yl)methyl]butanamide
PubChem CID122353332
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC Name2-ethyl-N-[(2-morpholin-4-ylpyrimidin-4-yl)methyl]butanamide
SMILESCCC(CC)C(=O)NCc1ccnc(N2CCOCC2)n1
InChIInChI=1S/C15H24N4O2/c1-3-12(4-2)14(20)17-11-13-5-6-16-15(18-13)19-7-9-21-10-8-19/h5-6,12H,3-4,7-11H2,1-2H3,(H,17,20)
InChIKeyVWEUWKRENBHKPI-UHFFFAOYSA-N
XLogP1.37
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(2-morpholin-4-ylpyrimidin-4-yl)methyl]-1,2-oxazole-5-carboxamide
CID 122353371
4-bromo-N-[(2-morpholin-4-ylpyrimidin-4-yl)methyl]benzamide
CID 122353608
2,6-difluoro-N-[(2-morpholin-4-ylpyrimidin-4-yl)methyl]benzamide
CID 91967358
N-[(2-morpholin-4-ylpyrimidin-4-yl)methyl]naphthalene-1-carboxamide
CID 91967362
2,4-dichloro-N-[(2-morpholin-4-ylpyrimidin-4-yl)methyl]benzamide
CID 91967359
4-[4-[(dimethylsulfamoylamino)methyl]pyrimidin-2-yl]morpholine
CID 122353348
1-(2-morpholin-4-ylpyrimidin-4-yl)propan-1-one
CID 170035961
1-(3-methylphenyl)-3-[(2-morpholin-4-ylpyrimidin-4-yl)methyl]urea
CID 91967391
1-(2,3-dimethoxyphenyl)-3-[(2-morpholin-4-ylpyrimidin-4-yl)methyl]urea
CID 122353603
2-(4,5-dimethyl-6-oxopyrimidin-1-yl)-N-[(2-morpholin-4-ylpyrimidin-4-yl)methyl]acetamide
CID 122353478
N-[(2-morpholin-4-ylpyrimidin-4-yl)methyl]-2-(6-oxopyridazin-1-yl)acetamide
CID 122353494
N-[2-(dimethylamino)ethyl]-2-morpholin-4-ylpyrimidine-4-carboxamide
CID 109300337

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-[(2-morpholin-4-ylpyrimidin-4-yl)methyl]butanamide?
The IUPAC name of 2-ethyl-N-[(2-morpholin-4-ylpyrimidin-4-yl)methyl]butanamide (CID 122353332) is 2-ethyl-N-[(2-morpholin-4-ylpyrimidin-4-yl)methyl]butanamide.
What is the SMILES notation for 2-ethyl-N-[(2-morpholin-4-ylpyrimidin-4-yl)methyl]butanamide?
The canonical SMILES for 2-ethyl-N-[(2-morpholin-4-ylpyrimidin-4-yl)methyl]butanamide is CCC(CC)C(=O)NCc1ccnc(N2CCOCC2)n1.
What is the InChIKey of 2-ethyl-N-[(2-morpholin-4-ylpyrimidin-4-yl)methyl]butanamide?
The InChIKey is VWEUWKRENBHKPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-3-12(4-2)14(20)17-11-13-5-6-16-15(18-13)19-7-9-21-10-8-19/h5-6,12H,3-4,7-11H2,1-2H3,(H,17,20).
What are the key properties of 2-ethyl-N-[(2-morpholin-4-ylpyrimidin-4-yl)methyl]butanamide?
2-ethyl-N-[(2-morpholin-4-ylpyrimidin-4-yl)methyl]butanamide has a molecular weight of 292.38 g/mol, XLogP of 1.37, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-[(2-morpholin-4-ylpyrimidin-4-yl)methyl]butanamide is sourced from PubChem (CID 122353332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).