N-(3-methoxypropyl)-2-(2-oxopyrimidin-1-yl)acetamide

C10H15N3O3 — CID 39891646

IUPACN-(3-methoxypropyl)-2-(2-oxopyrimidin-1-yl)acetamide
SMILESCOCCCNC(=O)Cn1cccnc1=O
InChIInChI=1S/C10H15N3O3/c1-16-7-3-5-11-9(14)8-13-6-2-4-12-10(13)15/h2,4,6H,3,5,7-8H2,1H3,(H,11,14)
InChIKeyILCWAGZEEHFFEP-UHFFFAOYSA-N
MW225.25 g/mol
LogP-0.60
Rot. Bonds6

About N-(3-methoxypropyl)-2-(2-oxopyrimidin-1-yl)acetamide

N-(3-methoxypropyl)-2-(2-oxopyrimidin-1-yl)acetamide (PubChem CID 39891646) has the molecular formula C10H15N3O3 and a molecular weight of 225.25 g/mol. Its IUPAC name is N-(3-methoxypropyl)-2-(2-oxopyrimidin-1-yl)acetamide.

Molecular Properties

Compound NameN-(3-methoxypropyl)-2-(2-oxopyrimidin-1-yl)acetamide
PubChem CID39891646
Molecular FormulaC10H15N3O3
Molecular Weight225.25 g/mol
Exact Mass225.11
IUPAC NameN-(3-methoxypropyl)-2-(2-oxopyrimidin-1-yl)acetamide
SMILESCOCCCNC(=O)Cn1cccnc1=O
InChIInChI=1S/C10H15N3O3/c1-16-7-3-5-11-9(14)8-13-6-2-4-12-10(13)15/h2,4,6H,3,5,7-8H2,1H3,(H,11,14)
InChIKeyILCWAGZEEHFFEP-UHFFFAOYSA-N
XLogP-0.60
TPSA73.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 5-0.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(4-amino-2-oxopyrimidin-1-yl)-N-(3-methoxypropyl)acetamide
CID 44144255
N-[3-(cyclopentyloxy)propyl]-2-(2-oxopyrimidin-1(2H)-yl)acetamide
CID 49047645
N-(2-ethoxyethyl)-2-(2-oxopyrimidin-1-yl)acetamide
CID 122132565
2,2-dimethyl-N-[2-(2-oxo-1,2-dihydropyrimidin-1-yl)ethyl]propanamide
CID 131703148
2-(2-oxopyrimidin-1-yl)-N-(2,2,2-trifluoroethyl)acetamide
CID 40205261
N-(2,2-difluoro-3-hydroxypropyl)-2-(2-oxopyrimidin-1-yl)acetamide
CID 113462689
2-(2-oxopyrimidin-1-yl)-N-propan-2-ylacetamide
CID 60758847
N-ethyl-1,2-dihydropyrimidine-2-carboxamide
CID 151565733
N-[2-(methylamino)ethyl]-N-(2-oxopropyl)-2-(2-oxopyrimidin-1-yl)acetamide
CID 167286972
1-(2-Oxo-2-piperazin-1-ylethyl)pyrimidin-2-one
CID 24706601
N-(3-methylbutyl)-2-(2-oxopyrimidin-1-yl)acetamide
CID 39004583
N-(2-methylbutan-2-yl)-2-(2-oxopyrimidin-1-yl)acetamide
CID 39007509

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxypropyl)-2-(2-oxopyrimidin-1-yl)acetamide?
The IUPAC name of N-(3-methoxypropyl)-2-(2-oxopyrimidin-1-yl)acetamide (CID 39891646) is N-(3-methoxypropyl)-2-(2-oxopyrimidin-1-yl)acetamide.
What is the SMILES notation for N-(3-methoxypropyl)-2-(2-oxopyrimidin-1-yl)acetamide?
The canonical SMILES for N-(3-methoxypropyl)-2-(2-oxopyrimidin-1-yl)acetamide is COCCCNC(=O)Cn1cccnc1=O.
What is the InChIKey of N-(3-methoxypropyl)-2-(2-oxopyrimidin-1-yl)acetamide?
The InChIKey is ILCWAGZEEHFFEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O3/c1-16-7-3-5-11-9(14)8-13-6-2-4-12-10(13)15/h2,4,6H,3,5,7-8H2,1H3,(H,11,14).
What are the key properties of N-(3-methoxypropyl)-2-(2-oxopyrimidin-1-yl)acetamide?
N-(3-methoxypropyl)-2-(2-oxopyrimidin-1-yl)acetamide has a molecular weight of 225.25 g/mol, XLogP of -0.60, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxypropyl)-2-(2-oxopyrimidin-1-yl)acetamide is sourced from PubChem (CID 39891646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).