5-Acetylamino-3-methyl-uracil

C7H9N3O3 — CID 129852102

IUPACN-(3-methyl-2,4-dioxo-1H-pyrimidin-5-yl)acetamide
SMILESCC(=O)NC1=CNC(=O)N(C1=O)C
InChIInChI=1S/C7H9N3O3/c1-4(11)9-5-3-8-7(13)10(2)6(5)12/h3H,1-2H3,(H,8,13)(H,9,11)
InChIKeyYFWKUEUDICBVCQ-UHFFFAOYSA-N
MW183.16 g/mol
LogP-1.40
Rot. Bonds1

About 5-Acetylamino-3-methyl-uracil

5-Acetylamino-3-methyl-uracil (PubChem CID 129852102) has the molecular formula C7H9N3O3 and a molecular weight of 183.16 g/mol. Its IUPAC name is N-(3-methyl-2,4-dioxo-1H-pyrimidin-5-yl)acetamide.

Molecular Properties

Compound Name5-Acetylamino-3-methyl-uracil
PubChem CID129852102
Molecular FormulaC7H9N3O3
Molecular Weight183.16 g/mol
Exact Mass183.06
IUPAC NameN-(3-methyl-2,4-dioxo-1H-pyrimidin-5-yl)acetamide
SMILESCC(=O)NC1=CNC(=O)N(C1=O)C
InChIInChI=1S/C7H9N3O3/c1-4(11)9-5-3-8-7(13)10(2)6(5)12/h3H,1-2H3,(H,8,13)(H,9,11)
InChIKeyYFWKUEUDICBVCQ-UHFFFAOYSA-N
XLogP-1.40
TPSA78.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity308

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.16
LogP ≤ 5-1.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-Acetylamino-6-amino-3-methyluracil
CID 88299
5-Aminouracil
CID 13611
5-(4-methylpiperazin-1-yl)-1H-pyrimidine-2,4-dione
CID 651501
6-Amino-5-(butylamino)-1-propylpyrimidine-2,4(1H,3H)-dione
CID 2398074
5-[Bis(2-chloroethyl)amino]-3-methylpyrimidine-2,4(1h,3h)-dione
CID 239403
5-Amino-1-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione
CID 265774
6-Amino-1-butyl-5-(propylamino)-1,2,3,4-tetrahydropyrimidine-2,4-dione
CID 2363721
6-Amino-1-butyl-5-(ethylamino)-1,2,3,4-tetrahydropyrimidine-2,4-dione
CID 2393504
5-(Dimethylamino)uracil
CID 255552
N-hexyl-5-methylamino-2,4-dioxo-pyrimidine-1-carboxamide
CID 71654964
5-Amino-1,3-dimethyl-1,2,3,4-tetrahydropyrimidine-2,4-dione
CID 250711
N-Isopropyl-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxamide
CID 2227167

Frequently Asked Questions

What is the IUPAC name of 5-Acetylamino-3-methyl-uracil?
The IUPAC name of 5-Acetylamino-3-methyl-uracil (CID 129852102) is N-(3-methyl-2,4-dioxo-1H-pyrimidin-5-yl)acetamide.
What is the SMILES notation for 5-Acetylamino-3-methyl-uracil?
The canonical SMILES for 5-Acetylamino-3-methyl-uracil is CC(=O)NC1=CNC(=O)N(C1=O)C.
What is the InChIKey of 5-Acetylamino-3-methyl-uracil?
The InChIKey is YFWKUEUDICBVCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3O3/c1-4(11)9-5-3-8-7(13)10(2)6(5)12/h3H,1-2H3,(H,8,13)(H,9,11).
What are the key properties of 5-Acetylamino-3-methyl-uracil?
5-Acetylamino-3-methyl-uracil has a molecular weight of 183.16 g/mol, XLogP of -1.40, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-Acetylamino-3-methyl-uracil is sourced from PubChem (CID 129852102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).