2-[1-[(2R)-3,4-dihydroxy-5-(hydroxymethyl)-2,3-dihydrofuran-2-yl]-2,4-dioxopyrimidin-5-yl]acetamide

C11H13N3O7 — CID 144647514

IUPAC2-[1-[(2R)-3,4-dihydroxy-5-(hydroxymethyl)-2,3-dihydrofuran-2-yl]-2,4-dioxopyrimidin-5-yl]acetamide
SMILESNC(=O)Cc1cn([C@@H]2OC(CO)=C(O)C2O)c(=O)[nH]c1=O
InChIInChI=1S/C11H13N3O7/c12-6(16)1-4-2-14(11(20)13-9(4)19)10-8(18)7(17)5(3-15)21-10/h2,8,10,15,17-18H,1,3H2,(H2,12,16)(H,13,19,20)/t8?,10-/m1/s1
InChIKeyCSZSZUKPECVTBN-LHIURRSHSA-N
MW299.24 g/mol
LogP-2.78
Rot. Bonds4

About 2-[1-[(2R)-3,4-dihydroxy-5-(hydroxymethyl)-2,3-dihydrofuran-2-yl]-2,4-dioxopyrimidin-5-yl]acetamide

2-[1-[(2R)-3,4-dihydroxy-5-(hydroxymethyl)-2,3-dihydrofuran-2-yl]-2,4-dioxopyrimidin-5-yl]acetamide (PubChem CID 144647514) has the molecular formula C11H13N3O7 and a molecular weight of 299.24 g/mol. Its IUPAC name is 2-[1-[(2R)-3,4-dihydroxy-5-(hydroxymethyl)-2,3-dihydrofuran-2-yl]-2,4-dioxopyrimidin-5-yl]acetamide.

Molecular Properties

Compound Name2-[1-[(2R)-3,4-dihydroxy-5-(hydroxymethyl)-2,3-dihydrofuran-2-yl]-2,4-dioxopyrimidin-5-yl]acetamide
PubChem CID144647514
Molecular FormulaC11H13N3O7
Molecular Weight299.24 g/mol
Exact Mass299.08
IUPAC Name2-[1-[(2R)-3,4-dihydroxy-5-(hydroxymethyl)-2,3-dihydrofuran-2-yl]-2,4-dioxopyrimidin-5-yl]acetamide
SMILESNC(=O)Cc1cn([C@@H]2OC(CO)=C(O)C2O)c(=O)[nH]c1=O
InChIInChI=1S/C11H13N3O7/c12-6(16)1-4-2-14(11(20)13-9(4)19)10-8(18)7(17)5(3-15)21-10/h2,8,10,15,17-18H,1,3H2,(H2,12,16)(H,13,19,20)/t8?,10-/m1/s1
InChIKeyCSZSZUKPECVTBN-LHIURRSHSA-N
XLogP-2.78
TPSA167.87 Ų
H-Bond Donors5
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.24
LogP ≤ 5-2.78
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 108

Analyze 2-[1-[(2R)-3,4-dihydroxy-5-(hydroxymethyl)-2,3-dihydrofuran-2-yl]-2,4-dioxopyrimidin-5-yl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[(2R)-3,4-dihydroxy-5-(hydroxymethyl)-2,3-dihydrofuran-2-yl]-5-[(1-phenyltriazol-4-yl)methyl]pyrimidine-2,4-dione
CID 144823767
2-[1-[(2S,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2,4-dioxopyrimidin-5-yl]acetic acid
CID 57091267
1-[(2S,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-(2-oxopropyl)pyrimidine-2,4-dione
CID 57450617
1-[(2S,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-(2-hydroxyethyl)pyrimidine-2,4-dione
CID 57210215
2-[1-[(2R,5R)-5-[(2,6-dihydroxy-2,4,6-trioxo-1,3,2λ5,4λ5,6λ5-dioxatriphosphinan-4-yl)oxymethyl]-3,4-dihydroxyoxolan-2-yl]-2,4-dioxopyrimidin-5-yl]acetamide
CID 129264449
2-[1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2,4-dioxopyrimidin-5-yl]-2-hydroxyacetic acid;2-[1-[(2R,3R,4S,5R)-4-hydroxy-5-(hydroxymethyl)-3-methoxyoxolan-2-yl]-2,4-dioxopyrimidin-5-yl]acetamide
CID 175209111
N-[[1-[(2R)-5-[[chloro(methyl)phosphoryl]oxymethyl]-3,4-dihydroxy-2,3-dihydrofuran-2-yl]-2,4-dioxopyrimidin-5-yl]methyl]-2,2,2-trifluoro-N-(3-methylbut-2-enyl)acetamide
CID 144981915
3-[1-[(2S,5S)-3-hydroxy-5-(hydroxymethyl)-4-iodooxolan-2-yl]-2,4-dioxopyrimidin-5-yl]-2-oxopropanal
CID 91323802
N-[[1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2,4-dioxopyrimidin-5-yl]methyl]formamide
CID 175538459
1-[(2R,3S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-(3-oxobutyl)pyrimidine-2,4-dione
CID 59207871
5-amino-1-[(2S,3R,4S,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidine-2,4-dione
CID 7272022
1-[(2R,3S,4R,5R)-4-bromo-3-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-ethylpyrimidine-2,4-dione
CID 67463464

Frequently Asked Questions

What is the IUPAC name of 2-[1-[(2R)-3,4-dihydroxy-5-(hydroxymethyl)-2,3-dihydrofuran-2-yl]-2,4-dioxopyrimidin-5-yl]acetamide?
The IUPAC name of 2-[1-[(2R)-3,4-dihydroxy-5-(hydroxymethyl)-2,3-dihydrofuran-2-yl]-2,4-dioxopyrimidin-5-yl]acetamide (CID 144647514) is 2-[1-[(2R)-3,4-dihydroxy-5-(hydroxymethyl)-2,3-dihydrofuran-2-yl]-2,4-dioxopyrimidin-5-yl]acetamide.
What is the SMILES notation for 2-[1-[(2R)-3,4-dihydroxy-5-(hydroxymethyl)-2,3-dihydrofuran-2-yl]-2,4-dioxopyrimidin-5-yl]acetamide?
The canonical SMILES for 2-[1-[(2R)-3,4-dihydroxy-5-(hydroxymethyl)-2,3-dihydrofuran-2-yl]-2,4-dioxopyrimidin-5-yl]acetamide is NC(=O)Cc1cn([C@@H]2OC(CO)=C(O)C2O)c(=O)[nH]c1=O.
What is the InChIKey of 2-[1-[(2R)-3,4-dihydroxy-5-(hydroxymethyl)-2,3-dihydrofuran-2-yl]-2,4-dioxopyrimidin-5-yl]acetamide?
The InChIKey is CSZSZUKPECVTBN-LHIURRSHSA-N. The full InChI is InChI=1S/C11H13N3O7/c12-6(16)1-4-2-14(11(20)13-9(4)19)10-8(18)7(17)5(3-15)21-10/h2,8,10,15,17-18H,1,3H2,(H2,12,16)(H,13,19,20)/t8?,10-/m1/s1.
What are the key properties of 2-[1-[(2R)-3,4-dihydroxy-5-(hydroxymethyl)-2,3-dihydrofuran-2-yl]-2,4-dioxopyrimidin-5-yl]acetamide?
2-[1-[(2R)-3,4-dihydroxy-5-(hydroxymethyl)-2,3-dihydrofuran-2-yl]-2,4-dioxopyrimidin-5-yl]acetamide has a molecular weight of 299.24 g/mol, XLogP of -2.78, 4 rotatable bonds, 5 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[(2R)-3,4-dihydroxy-5-(hydroxymethyl)-2,3-dihydrofuran-2-yl]-2,4-dioxopyrimidin-5-yl]acetamide is sourced from PubChem (CID 144647514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).