6-[bis(2-methoxyethyl)amino]-1H-pyrimidine-2,4-dione

C10H17N3O4 — CID 121205368

IUPAC6-[bis(2-methoxyethyl)amino]-1H-pyrimidine-2,4-dione
SMILESCOCCN(CCOC)c1cc(=O)[nH]c(=O)[nH]1
InChIInChI=1S/C10H17N3O4/c1-16-5-3-13(4-6-17-2)8-7-9(14)12-10(15)11-8/h7H,3-6H2,1-2H3,(H2,11,12,14,15)
InChIKeyVNJQVQHLDBIGPD-UHFFFAOYSA-N
MW243.26 g/mol
LogP-0.84
Rot. Bonds7

About 6-[bis(2-methoxyethyl)amino]-1H-pyrimidine-2,4-dione

6-[bis(2-methoxyethyl)amino]-1H-pyrimidine-2,4-dione (PubChem CID 121205368) has the molecular formula C10H17N3O4 and a molecular weight of 243.26 g/mol. Its IUPAC name is 6-[bis(2-methoxyethyl)amino]-1H-pyrimidine-2,4-dione.

Molecular Properties

Compound Name6-[bis(2-methoxyethyl)amino]-1H-pyrimidine-2,4-dione
PubChem CID121205368
Molecular FormulaC10H17N3O4
Molecular Weight243.26 g/mol
Exact Mass243.12
IUPAC Name6-[bis(2-methoxyethyl)amino]-1H-pyrimidine-2,4-dione
SMILESCOCCN(CCOC)c1cc(=O)[nH]c(=O)[nH]1
InChIInChI=1S/C10H17N3O4/c1-16-5-3-13(4-6-17-2)8-7-9(14)12-10(15)11-8/h7H,3-6H2,1-2H3,(H2,11,12,14,15)
InChIKeyVNJQVQHLDBIGPD-UHFFFAOYSA-N
XLogP-0.84
TPSA87.42 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.26
LogP ≤ 5-0.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-[2-methoxyethyl(methyl)amino]-1H-pyridin-2-one
CID 168942083
2-[2-methoxyethyl(methyl)amino]-4-phenyl-1H-pyrimidin-6-one
CID 136575811
2-(2,4-dioxo-1H-pyrimidin-6-yl)-N-(2-hydroxy-4-methoxy-2-methylbutyl)acetamide
CID 106250518
N-(2-methoxyethyl)-N-methyl-2-oxo-1H-pyridine-4-carboxamide
CID 103764343
methyl 2-[(2,4-dioxo-1H-pyrimidine-6-carbonyl)-propylamino]acetate
CID 55005954
6-methyl-1H-pyrimidine-2,4-dione
CID 160901514
2-(2-methoxyethyl)-4-(3-methoxypropyl)-1H-pyrimidin-6-one
CID 136678766
[2-[bis(2-methoxyethyl)amino]-2-oxoethyl] 2-oxo-1H-quinoline-4-carboxylate
CID 2435886
3-N,3-N,7-N,7-N-tetrakis(2-methoxyethyl)-1,9-dimethyl-10H-phenothiazine-3,7-diamine
CID 90338788
3-[ethyl(2-methoxyethyl)amino]-1H-pyrazin-2-one
CID 115657183
6-[bis(2-methoxyethyl)amino]-5-chloro-1H-indole-2,3-dione
CID 79342525
methyl 3-[(3,5-dioxo-2H-1,2,4-triazin-6-yl)-(2-methoxyethyl)amino]propanoate
CID 80703580

Frequently Asked Questions

What is the IUPAC name of 6-[bis(2-methoxyethyl)amino]-1H-pyrimidine-2,4-dione?
The IUPAC name of 6-[bis(2-methoxyethyl)amino]-1H-pyrimidine-2,4-dione (CID 121205368) is 6-[bis(2-methoxyethyl)amino]-1H-pyrimidine-2,4-dione.
What is the SMILES notation for 6-[bis(2-methoxyethyl)amino]-1H-pyrimidine-2,4-dione?
The canonical SMILES for 6-[bis(2-methoxyethyl)amino]-1H-pyrimidine-2,4-dione is COCCN(CCOC)c1cc(=O)[nH]c(=O)[nH]1.
What is the InChIKey of 6-[bis(2-methoxyethyl)amino]-1H-pyrimidine-2,4-dione?
The InChIKey is VNJQVQHLDBIGPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O4/c1-16-5-3-13(4-6-17-2)8-7-9(14)12-10(15)11-8/h7H,3-6H2,1-2H3,(H2,11,12,14,15).
What are the key properties of 6-[bis(2-methoxyethyl)amino]-1H-pyrimidine-2,4-dione?
6-[bis(2-methoxyethyl)amino]-1H-pyrimidine-2,4-dione has a molecular weight of 243.26 g/mol, XLogP of -0.84, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[bis(2-methoxyethyl)amino]-1H-pyrimidine-2,4-dione is sourced from PubChem (CID 121205368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).