2-(2,4-dioxopyrimidin-1-yl)-N-[(1R)-1-(4-ethylphenyl)-2-methylpropyl]acetamide

C18H23N3O3 — CID 31353018

IUPAC2-(2,4-dioxopyrimidin-1-yl)-N-[(1R)-1-(4-ethylphenyl)-2-methylpropyl]acetamide
SMILESCCc1ccc([C@H](NC(=O)Cn2ccc(=O)[nH]c2=O)C(C)C)cc1
InChIInChI=1S/C18H23N3O3/c1-4-13-5-7-14(8-6-13)17(12(2)3)19-16(23)11-21-10-9-15(22)20-18(21)24/h5-10,12,17H,4,11H2,1-3H3,(H,19,23)(H,20,22,24)/t17-/m1/s1
InChIKeyIKTNKUBKAQORGX-QGZVFWFLSA-N
MW329.40 g/mol
LogP1.61
Rot. Bonds6

About 2-(2,4-dioxopyrimidin-1-yl)-N-[(1R)-1-(4-ethylphenyl)-2-methylpropyl]acetamide

2-(2,4-dioxopyrimidin-1-yl)-N-[(1R)-1-(4-ethylphenyl)-2-methylpropyl]acetamide (PubChem CID 31353018) has the molecular formula C18H23N3O3 and a molecular weight of 329.40 g/mol. Its IUPAC name is 2-(2,4-dioxopyrimidin-1-yl)-N-[(1R)-1-(4-ethylphenyl)-2-methylpropyl]acetamide.

Molecular Properties

Compound Name2-(2,4-dioxopyrimidin-1-yl)-N-[(1R)-1-(4-ethylphenyl)-2-methylpropyl]acetamide
PubChem CID31353018
Molecular FormulaC18H23N3O3
Molecular Weight329.40 g/mol
Exact Mass329.17
IUPAC Name2-(2,4-dioxopyrimidin-1-yl)-N-[(1R)-1-(4-ethylphenyl)-2-methylpropyl]acetamide
SMILESCCc1ccc([C@H](NC(=O)Cn2ccc(=O)[nH]c2=O)C(C)C)cc1
InChIInChI=1S/C18H23N3O3/c1-4-13-5-7-14(8-6-13)17(12(2)3)19-16(23)11-21-10-9-15(22)20-18(21)24/h5-10,12,17H,4,11H2,1-3H3,(H,19,23)(H,20,22,24)/t17-/m1/s1
InChIKeyIKTNKUBKAQORGX-QGZVFWFLSA-N
XLogP1.61
TPSA83.96 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.40
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(2,4-dioxopyrimidin-1-yl)-N-[(1R)-1-(4-ethylphenyl)-2-methylpropyl]acetamide with MolForge

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Related Compounds

N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methylpropyl]-2-(2,4-dioxopyrimidin-1-yl)acetamide
CID 42941035
N-[(1R)-1-(4-cyanophenyl)ethyl]-2-(2,4-dioxopyrimidin-1-yl)acetamide
CID 33356226
2-(2,4-dioxopyrimidin-1-yl)-N-(1-hydroxypentan-3-yl)acetamide
CID 113264415
2-(2,4-dioxopyrimidin-1-yl)-N-methylacetamide
CID 60699315
2-[[2-(2,4-dioxopyrimidin-1-yl)acetyl]amino]-4-methylpentanoic acid
CID 43170165
N-[(1S)-1-(4-ethylphenyl)-2-methylpropyl]-2-(4-oxoquinazolin-3-yl)acetamide
CID 9287316
N-[1-(4-ethylphenyl)-2-methylpropyl]-2-(2-oxo-1,3-thiazolidin-3-yl)acetamide
CID 18090465
2-(2,4-dioxopyrimidin-1-yl)-N-[(4-propan-2-ylphenyl)-thiophen-2-ylmethyl]acetamide
CID 42925044
2-(2,4-dioxopyrimidin-1-yl)-N-[(2S)-2-hydroxypropyl]acetamide
CID 83030551
2-(2,4-dioxopyrimidin-1-yl)-N-propylacetamide
CID 30662441
2-(3-benzyl-2,4,5-trioxoimidazolidin-1-yl)-N-[(1R)-1-(4-ethylphenyl)-2-methylpropyl]acetamide
CID 9073243
2-(2,4-dioxopyrimidin-1-yl)acetohydrazide
CID 43236986

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dioxopyrimidin-1-yl)-N-[(1R)-1-(4-ethylphenyl)-2-methylpropyl]acetamide?
The IUPAC name of 2-(2,4-dioxopyrimidin-1-yl)-N-[(1R)-1-(4-ethylphenyl)-2-methylpropyl]acetamide (CID 31353018) is 2-(2,4-dioxopyrimidin-1-yl)-N-[(1R)-1-(4-ethylphenyl)-2-methylpropyl]acetamide.
What is the SMILES notation for 2-(2,4-dioxopyrimidin-1-yl)-N-[(1R)-1-(4-ethylphenyl)-2-methylpropyl]acetamide?
The canonical SMILES for 2-(2,4-dioxopyrimidin-1-yl)-N-[(1R)-1-(4-ethylphenyl)-2-methylpropyl]acetamide is CCc1ccc([C@H](NC(=O)Cn2ccc(=O)[nH]c2=O)C(C)C)cc1.
What is the InChIKey of 2-(2,4-dioxopyrimidin-1-yl)-N-[(1R)-1-(4-ethylphenyl)-2-methylpropyl]acetamide?
The InChIKey is IKTNKUBKAQORGX-QGZVFWFLSA-N. The full InChI is InChI=1S/C18H23N3O3/c1-4-13-5-7-14(8-6-13)17(12(2)3)19-16(23)11-21-10-9-15(22)20-18(21)24/h5-10,12,17H,4,11H2,1-3H3,(H,19,23)(H,20,22,24)/t17-/m1/s1.
What are the key properties of 2-(2,4-dioxopyrimidin-1-yl)-N-[(1R)-1-(4-ethylphenyl)-2-methylpropyl]acetamide?
2-(2,4-dioxopyrimidin-1-yl)-N-[(1R)-1-(4-ethylphenyl)-2-methylpropyl]acetamide has a molecular weight of 329.40 g/mol, XLogP of 1.61, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dioxopyrimidin-1-yl)-N-[(1R)-1-(4-ethylphenyl)-2-methylpropyl]acetamide is sourced from PubChem (CID 31353018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).