2-cyclopentyl-5-hydroxy-3-(2-hydroxyethyl)-4,5-dihydropyrimidin-6-one

C11H18N2O3 — CID 123937642

IUPAC2-cyclopentyl-5-hydroxy-3-(2-hydroxyethyl)-4,5-dihydropyrimidin-6-one
SMILESO=C1N=C(C2CCCC2)N(CCO)CC1O
InChIInChI=1S/C11H18N2O3/c14-6-5-13-7-9(15)11(16)12-10(13)8-3-1-2-4-8/h8-9,14-15H,1-7H2
InChIKeyDYWPUGHLYUXXGI-UHFFFAOYSA-N
MW226.28 g/mol
LogP-0.23
Rot. Bonds3

About 2-cyclopentyl-5-hydroxy-3-(2-hydroxyethyl)-4,5-dihydropyrimidin-6-one

2-cyclopentyl-5-hydroxy-3-(2-hydroxyethyl)-4,5-dihydropyrimidin-6-one (PubChem CID 123937642) has the molecular formula C11H18N2O3 and a molecular weight of 226.28 g/mol. Its IUPAC name is 2-cyclopentyl-5-hydroxy-3-(2-hydroxyethyl)-4,5-dihydropyrimidin-6-one.

Molecular Properties

Compound Name2-cyclopentyl-5-hydroxy-3-(2-hydroxyethyl)-4,5-dihydropyrimidin-6-one
PubChem CID123937642
Molecular FormulaC11H18N2O3
Molecular Weight226.28 g/mol
Exact Mass226.13
IUPAC Name2-cyclopentyl-5-hydroxy-3-(2-hydroxyethyl)-4,5-dihydropyrimidin-6-one
SMILESO=C1N=C(C2CCCC2)N(CCO)CC1O
InChIInChI=1S/C11H18N2O3/c14-6-5-13-7-9(15)11(16)12-10(13)8-3-1-2-4-8/h8-9,14-15H,1-7H2
InChIKeyDYWPUGHLYUXXGI-UHFFFAOYSA-N
XLogP-0.23
TPSA73.13 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 5-0.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(3S,4R,5R)-3,4,5-trihydroxy-1-(2-hydroxyethyl)piperidin-2-one
CID 44566015
3,4-dihydroxy-1-(2-hydroxyethyl)pyrrolidin-2-one
CID 123921476
3-(2-hydroxyethyl)-4,4a,5,6,7,7a-hexahydro-1H-cyclopenta[d]pyrimidin-2-one
CID 105441140
cyclobutanol;1-(2-hydroxyethyl)imidazolidin-2-one
CID 174844984
1,4-bis(2-hydroxyethyl)piperazine-2,5-dione
CID 15646785
5-amino-1-(2-hydroxyethyl)piperidin-2-one;hydrochloride
CID 69008245
(4R)-1-(2-hydroxyethyl)-4-methylpyrrolidin-2-one
CID 170372384
1-(2-hydroxyethyl)-4-methylpyrrolidin-2-one
CID 63100627
1-(2-hydroxyethyl)-4-sulfanylpyrrolidin-2-one
CID 168709345
(3S)-3-amino-1-(2-hydroxyethyl)pyrrolidin-2-one;hydrochloride
CID 67416985
arsane;1-(2-hydroxyethyl)pyrrolidin-2-one
CID 174911308
2-hydroxy-1-(2-hydroxyethyl)pyrrolidin-3-one
CID 173052176

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-5-hydroxy-3-(2-hydroxyethyl)-4,5-dihydropyrimidin-6-one?
The IUPAC name of 2-cyclopentyl-5-hydroxy-3-(2-hydroxyethyl)-4,5-dihydropyrimidin-6-one (CID 123937642) is 2-cyclopentyl-5-hydroxy-3-(2-hydroxyethyl)-4,5-dihydropyrimidin-6-one.
What is the SMILES notation for 2-cyclopentyl-5-hydroxy-3-(2-hydroxyethyl)-4,5-dihydropyrimidin-6-one?
The canonical SMILES for 2-cyclopentyl-5-hydroxy-3-(2-hydroxyethyl)-4,5-dihydropyrimidin-6-one is O=C1N=C(C2CCCC2)N(CCO)CC1O.
What is the InChIKey of 2-cyclopentyl-5-hydroxy-3-(2-hydroxyethyl)-4,5-dihydropyrimidin-6-one?
The InChIKey is DYWPUGHLYUXXGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O3/c14-6-5-13-7-9(15)11(16)12-10(13)8-3-1-2-4-8/h8-9,14-15H,1-7H2.
What are the key properties of 2-cyclopentyl-5-hydroxy-3-(2-hydroxyethyl)-4,5-dihydropyrimidin-6-one?
2-cyclopentyl-5-hydroxy-3-(2-hydroxyethyl)-4,5-dihydropyrimidin-6-one has a molecular weight of 226.28 g/mol, XLogP of -0.23, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-5-hydroxy-3-(2-hydroxyethyl)-4,5-dihydropyrimidin-6-one is sourced from PubChem (CID 123937642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).