2-(2,4-dioxopyrimidin-1-yl)-N-[[2-(phenoxymethyl)phenyl]methyl]acetamide

C20H19N3O4 — CID 17398844

IUPAC2-(2,4-dioxopyrimidin-1-yl)-N-[[2-(phenoxymethyl)phenyl]methyl]acetamide
SMILESO=C(Cn1ccc(=O)[nH]c1=O)NCc1ccccc1COc1ccccc1
InChIInChI=1S/C20H19N3O4/c24-18-10-11-23(20(26)22-18)13-19(25)21-12-15-6-4-5-7-16(15)14-27-17-8-2-1-3-9-17/h1-11H,12-14H2,(H,21,25)(H,22,24,26)
InChIKeyNRYWGQSYKNSVQU-UHFFFAOYSA-N
MW365.39 g/mol
LogP1.43
Rot. Bonds7

About 2-(2,4-dioxopyrimidin-1-yl)-N-[[2-(phenoxymethyl)phenyl]methyl]acetamide

2-(2,4-dioxopyrimidin-1-yl)-N-[[2-(phenoxymethyl)phenyl]methyl]acetamide (PubChem CID 17398844) has the molecular formula C20H19N3O4 and a molecular weight of 365.39 g/mol. Its IUPAC name is 2-(2,4-dioxopyrimidin-1-yl)-N-[[2-(phenoxymethyl)phenyl]methyl]acetamide.

Molecular Properties

Compound Name2-(2,4-dioxopyrimidin-1-yl)-N-[[2-(phenoxymethyl)phenyl]methyl]acetamide
PubChem CID17398844
Molecular FormulaC20H19N3O4
Molecular Weight365.39 g/mol
Exact Mass365.14
IUPAC Name2-(2,4-dioxopyrimidin-1-yl)-N-[[2-(phenoxymethyl)phenyl]methyl]acetamide
SMILESO=C(Cn1ccc(=O)[nH]c1=O)NCc1ccccc1COc1ccccc1
InChIInChI=1S/C20H19N3O4/c24-18-10-11-23(20(26)22-18)13-19(25)21-12-15-6-4-5-7-16(15)14-27-17-8-2-1-3-9-17/h1-11H,12-14H2,(H,21,25)(H,22,24,26)
InChIKeyNRYWGQSYKNSVQU-UHFFFAOYSA-N
XLogP1.43
TPSA93.19 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.39
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(2,5-dimethoxyphenyl)methyl]-2-(2,4-dioxopyrimidin-1-yl)acetamide
CID 33103569
2-(2,4-dioxopyrimidin-1-yl)-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]acetamide
CID 37489706
N-(1H-benzimidazol-2-ylmethyl)-2-(2,4-dioxopyrimidin-1-yl)acetamide
CID 146022159
2-(2,4-dioxopyrimidin-1-yl)-N-[2-(4-methylphenoxy)ethyl]acetamide
CID 9456600
2-(2,4-dioxopyrimidin-1-yl)-N-(1H-pyrazol-4-ylmethyl)acetamide
CID 54897021
2-(2,4-dioxopyrimidin-1-yl)-N-methylacetamide
CID 60699315
2-(2,4-dioxopyrimidin-1-yl)acetohydrazide
CID 43236986
N-(2-chloroprop-2-enyl)-2-(2,4-dioxopyrimidin-1-yl)acetamide
CID 115636712
2-(2,4-dioxopyrimidin-1-yl)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]acetamide
CID 9490208
2-(2,4-dioxopyrimidin-1-yl)-N-[(2S)-2-hydroxypropyl]acetamide
CID 83030551
1-[[[2-(2,4-dioxopyrimidin-1-yl)acetyl]amino]methyl]cyclopropane-1-carboxylic acid
CID 113311878
(2S)-4-[[2-(2,4-dioxopyrimidin-1-yl)acetyl]amino]-2-hydroxybutanoic acid
CID 107834517

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dioxopyrimidin-1-yl)-N-[[2-(phenoxymethyl)phenyl]methyl]acetamide?
The IUPAC name of 2-(2,4-dioxopyrimidin-1-yl)-N-[[2-(phenoxymethyl)phenyl]methyl]acetamide (CID 17398844) is 2-(2,4-dioxopyrimidin-1-yl)-N-[[2-(phenoxymethyl)phenyl]methyl]acetamide.
What is the SMILES notation for 2-(2,4-dioxopyrimidin-1-yl)-N-[[2-(phenoxymethyl)phenyl]methyl]acetamide?
The canonical SMILES for 2-(2,4-dioxopyrimidin-1-yl)-N-[[2-(phenoxymethyl)phenyl]methyl]acetamide is O=C(Cn1ccc(=O)[nH]c1=O)NCc1ccccc1COc1ccccc1.
What is the InChIKey of 2-(2,4-dioxopyrimidin-1-yl)-N-[[2-(phenoxymethyl)phenyl]methyl]acetamide?
The InChIKey is NRYWGQSYKNSVQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O4/c24-18-10-11-23(20(26)22-18)13-19(25)21-12-15-6-4-5-7-16(15)14-27-17-8-2-1-3-9-17/h1-11H,12-14H2,(H,21,25)(H,22,24,26).
What are the key properties of 2-(2,4-dioxopyrimidin-1-yl)-N-[[2-(phenoxymethyl)phenyl]methyl]acetamide?
2-(2,4-dioxopyrimidin-1-yl)-N-[[2-(phenoxymethyl)phenyl]methyl]acetamide has a molecular weight of 365.39 g/mol, XLogP of 1.43, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dioxopyrimidin-1-yl)-N-[[2-(phenoxymethyl)phenyl]methyl]acetamide is sourced from PubChem (CID 17398844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).