5-amino-4-[2-[2-methoxyethyl(methyl)amino]ethylamino]-1H-pyrimidin-6-one

C10H19N5O2 — CID 136975510

IUPAC5-amino-4-[2-[2-methoxyethyl(methyl)amino]ethylamino]-1H-pyrimidin-6-one
SMILESCOCCN(C)CCNc1nc[nH]c(=O)c1N
InChIInChI=1S/C10H19N5O2/c1-15(5-6-17-2)4-3-12-9-8(11)10(16)14-7-13-9/h7H,3-6,11H2,1-2H3,(H2,12,13,14,16)
InChIKeyPOYKZOCCVQZVHP-UHFFFAOYSA-N
MW241.29 g/mol
LogP-0.66
Rot. Bonds7

About 5-amino-4-[2-[2-methoxyethyl(methyl)amino]ethylamino]-1H-pyrimidin-6-one

5-amino-4-[2-[2-methoxyethyl(methyl)amino]ethylamino]-1H-pyrimidin-6-one (PubChem CID 136975510) has the molecular formula C10H19N5O2 and a molecular weight of 241.29 g/mol. Its IUPAC name is 5-amino-4-[2-[2-methoxyethyl(methyl)amino]ethylamino]-1H-pyrimidin-6-one.

Molecular Properties

Compound Name5-amino-4-[2-[2-methoxyethyl(methyl)amino]ethylamino]-1H-pyrimidin-6-one
PubChem CID136975510
Molecular FormulaC10H19N5O2
Molecular Weight241.29 g/mol
Exact Mass241.15
IUPAC Name5-amino-4-[2-[2-methoxyethyl(methyl)amino]ethylamino]-1H-pyrimidin-6-one
SMILESCOCCN(C)CCNc1nc[nH]c(=O)c1N
InChIInChI=1S/C10H19N5O2/c1-15(5-6-17-2)4-3-12-9-8(11)10(16)14-7-13-9/h7H,3-6,11H2,1-2H3,(H2,12,13,14,16)
InChIKeyPOYKZOCCVQZVHP-UHFFFAOYSA-N
XLogP-0.66
TPSA96.27 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 5-0.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

Pyrimidine, 5-diethylamino-4-ethylamino-6-hydroxy-
CID 171384170
N'-[(6-hydroxypyrimidin-4-yl)methyl]-N-(2-methoxyethyl)-N-propylurea
CID 137028656
5-amino-4-[2-(2,2-difluoroethoxy)ethylamino]-1H-pyrimidin-6-one
CID 136896830
5-amino-4-[2-(2,2,2-trifluoroethoxy)ethylamino]-1H-pyrimidin-6-one
CID 137016443
2-Amino-6-butoxy-3-methyl-5,6,7,8-tetrahydropteridin-4-one
CID 70432118
2,5-Diamino-6-((2-hydroxyethyl)amino)-3-methylpyrimidin-4(3H)-one
CID 70633393
Methyl 2-(7-methyl-6-oxo-8,9-dihydropurin-1-yl)ethanimidate
CID 134555119
2-Amino-9-(2-ethoxyethyl)-1,8-dihydropurin-8-id-6-one;ethane;yttrium
CID 135991965
4-amino-5-morpholin-4-yl-1H-pyrimidin-6-one
CID 136393190
4,5-bis[(2-amino-2-hydroxyethyl)amino]-1H-pyrimidin-6-one
CID 136477344
2-amino-5-(methylamino)-4-[(4-methylmorpholin-2-yl)amino]-1H-pyrimidin-6-one
CID 137179244
5-(1,3-Dimethoxypropan-2-ylamino)-3-methylpyrimidin-4-one
CID 140038027

Frequently Asked Questions

What is the IUPAC name of 5-amino-4-[2-[2-methoxyethyl(methyl)amino]ethylamino]-1H-pyrimidin-6-one?
The IUPAC name of 5-amino-4-[2-[2-methoxyethyl(methyl)amino]ethylamino]-1H-pyrimidin-6-one (CID 136975510) is 5-amino-4-[2-[2-methoxyethyl(methyl)amino]ethylamino]-1H-pyrimidin-6-one.
What is the SMILES notation for 5-amino-4-[2-[2-methoxyethyl(methyl)amino]ethylamino]-1H-pyrimidin-6-one?
The canonical SMILES for 5-amino-4-[2-[2-methoxyethyl(methyl)amino]ethylamino]-1H-pyrimidin-6-one is COCCN(C)CCNc1nc[nH]c(=O)c1N.
What is the InChIKey of 5-amino-4-[2-[2-methoxyethyl(methyl)amino]ethylamino]-1H-pyrimidin-6-one?
The InChIKey is POYKZOCCVQZVHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N5O2/c1-15(5-6-17-2)4-3-12-9-8(11)10(16)14-7-13-9/h7H,3-6,11H2,1-2H3,(H2,12,13,14,16).
What are the key properties of 5-amino-4-[2-[2-methoxyethyl(methyl)amino]ethylamino]-1H-pyrimidin-6-one?
5-amino-4-[2-[2-methoxyethyl(methyl)amino]ethylamino]-1H-pyrimidin-6-one has a molecular weight of 241.29 g/mol, XLogP of -0.66, 7 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-4-[2-[2-methoxyethyl(methyl)amino]ethylamino]-1H-pyrimidin-6-one is sourced from PubChem (CID 136975510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).